SCHEMBL3426595

SCHEMBL3426595

CCCCCCCCC(CCCCC=O)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
CETP P11597 3/20 0.43
FAAH O00519 3/20 0.41
TRPV1 Q8NER1 1/20 0.41
CSNK1E P49674 1/20 0.40
CTRC Q99895 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CNR2 P34972 1/20 0.39
EPHX2 P34913 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16177916 0.89 CTSK (0.42) CETPCNR2
SCHEMBL21695449 0.89 CTSK (0.41) TSHRCETPALDH1A1CYP3A4MAPK1
SCHEMBL9030758 0.87 CETP (0.43) CETPCSNK1ECTRCCNR2EPHX2
SCHEMBL16667474 0.87 CETP (0.43) CETPCSNK1ECTRCCNR2EPHX2
SCHEMBL9030769 0.87 CETP (0.43) CETPCSNK1ECTRCCNR2EPHX2
SCHEMBL11731022 0.86 CETP (0.41) TSHRCETPCSNK1ECTRCALDH1A1
SCHEMBL11731029 0.86 CETP (0.41) TSHRCETPCSNK1ECTRCALDH1A1
SCHEMBL28998085 0.85 CETP (0.45) CETPCSNK1ECTRCMAPK1CNR2
SCHEMBL3427566 0.83 EPHX2 (0.44) CETPFAAHALDH1A1CNR2EPHX2
SCHEMBL3427569 0.83 EPHX2 (0.44) CETPFAAHALDH1A1CNR2EPHX2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8871179-B2 Method for monitoring blood flow and metabolic uptake in tissue with radiolabeled alkanoic acid THE GENERAL HOSPITAL CORPORATION (US) 2014-10-28 US disclosed
US-20130052129-A1 METHOD FOR MONITORING BLOOD FLOW AND METABOLIC UPTAKE IN TISSUE WITH RADIOLABELED ALKANOIC ACID THE GENERAL HOSPITAL CORPORATION (US) 2013-02-28 US disclosed
US-8309053-B2 Method for monitoring blood flow and metabolic uptake in tissue with radiolabeled alkanoic acid THE GENERAL HOSPITAL CORPORATION (US) 2012-11-13 US disclosed
US-8268291-B2 Method for monitoring blood flow and metabolic uptake in tissue with radiolabeled alkanoic acid THE GENERAL HOSPITAL CORPORATION (US) 2012-09-18 US disclosed
US-7790142-B2 Using a radiolabeled fatty acid analog such as endo-[18F] fluoro- or [123I]iodo-3,4-cyclopropylheptadecanoic acid localized in tissue of interest, imaging, determining blood flow rate THE GENERAL HOSPITAL CORPORATION (US) 2010-09-07 US disclosed
US-20090156848-A1 METHOD FOR MONITORING BLOOD FLOW AND METABOLIC UPTAKE IN TISSUE WITH RADIOLABELED ALKANOIC ACID THE GENERAL HOSPITAL CORPORATION (US) 2009-06-18 US disclosed
US-7494642-B2 Fatty acid derivatives; tissue-targeted therapy; tomography; cardiovascular disorders; liver disorders; kits THE GENERAL HOSPITAL CORPORATION (US) 2009-02-24 US disclosed
US-20080214851-A1 Synthesis of labeled fatty acid analogs for use in tomography THE GENERAL HOSPITAL CORPORATION (US) 2008-09-04 US disclosed
US-20080213178-A1 Using a radiolabeled fatty acid analog such as endo-[18F] fluoro- or [123I]iodo-3,4-cyclopropylheptadecanoic acid localized in tissue of interest, imaging, determining blood flow rate THE GENERAL HOSPITAL CORPORATION (US) 2008-09-04 US disclosed
US-20080214853-A1 Labeled cycloalkylidene-containing fatty acid analogs; tissue-targeted therapy; tomography; block the catabolic pathway, thus trapping these analogs in a virtually unmodified form in the tissues of interest such as heart or tumor THE GENERAL HOSPITAL CORPORATION (US) 2008-09-04 US disclosed
US-20080213173-A1 Labeled fatty acid analogs; tissue-targeted therapy; tomography; block the catabolic pathway, thus trapping these analogs in a virtually unmodified form in the tissues of interest such as heart, liver, or tumor; endo-vinylic variants of cycloalkyl-substituted heptadecanoic acid for example THE GENERAL HOSPITAL CORPORATION (US) 2008-09-04 US disclosed
US-20080206135-A1 Using a radiolabeled fatty acid analog such as endo-[18F] fluoro- or [123I]iodo-3,4-cyclopropylheptadecanoic acid localized in tissue of interest, imaging, determining blood flow rate THE GENERAL HOSPITAL CORPORATION (US) 2008-08-28 US disclosed
EP-1622602-B1 METHOD FOR MONITORING BLOOD FLOW AND METABOLIC UPTAKE IN TISSUE WITH RADIOLABELED ALKANOIC ACID GEN HOSPITAL CORP (US) 2008-08-20 EP disclosed
US-20080095702-A1 Labeled fatty acid analogs; tissue-targeted therapy; tomography; block the catabolic pathway, thus trapping these analogs in a virtually unmodified form in the tissues of interest such as heart, liver, or tumor THE GENERAL HOSPITAL CORPORATION (US) 2008-04-24 US disclosed
EP-1622602-A4 METHOD FOR MONITORING BLOOD FLOW AND METABOLIC UPTAKE IN TISSUE WITH RADIOLABELED ALKANOIC ACID GEN HOSPITAL CORP (US) 2006-06-21 EP disclosed
EP-1622602-A2 METHOD FOR MONITORING BLOOD FLOW AND METABOLIC UPTAKE IN TISSUE WITH RADIOLABELED ALKANOIC ACID THE GENERAL HOSPITAL CORPORATION (US) 2006-02-08 EP disclosed
US-20040253177-A1 Fatty acid derivatives; tissue-targeted therapy; tomography; cardiovascular disorders; liver disorders; kits GENERAL HOSPITAL CORPORATION, THE 2004-12-16 US disclosed
WO-2004093650-A2 METHOD FOR MONITORING BLOOD FLOW AND METABOLIC UPTAKE IN TISSUE WITH RADIOLABELED ALKANOIC ACID THE GENERAL HOSPITAL CORPORATION (US) 2004-11-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130052129-A1 METHOD FOR MONITORING BLOOD FLOW AND METABOLIC UPTAKE IN TISSUE WITH RADIOLABELED ALKANOIC ACID FABP3, FABP1, SLC27A2 TSHR 1308/4885CETP 707/4885FAAH 66/4885
US-20080214851-A1 Synthesis of labeled fatty acid analogs for use in tomography FFAR4, FFAR3, FFAR2 TSHR 1189/4885CETP 386/4885FAAH 51/4885
US-20080214853-A1 Labeled cycloalkylidene-containing fatty acid analogs; tissue-targeted therapy; tomography; block the catabolic pathway, thus trapping these analogs in a virtually unmodified form in the tissues of interest such as heart or tumor FABP3, FFAR2, FFAR1 TSHR 917/4885CETP 476/4885FAAH 44/4885
US-20080206135-A1 Using a radiolabeled fatty acid analog such as endo-[18F] fluoro- or [123I]iodo-3,4-cyclopropylheptadecanoic acid localized in tissue of interest, imaging, determining blood flow rate FFAR3, FFAR2, FFAR1 TSHR 1155/4885CETP 473/4885FAAH 13/4885
US-20080213173-A1 Labeled fatty acid analogs; tissue-targeted therapy; tomography; block the catabolic pathway, thus trapping these analogs in a virtually unmodified form in the tissues of interest such as heart, liver, or tumor; endo-vinylic variants of cycloalkyl-substituted heptadecanoic acid for example FABP3, FABP1, FFAR2 TSHR 1016/4885CETP 445/4885FAAH 62/4885
US-20080095702-A1 Labeled fatty acid analogs; tissue-targeted therapy; tomography; block the catabolic pathway, thus trapping these analogs in a virtually unmodified form in the tissues of interest such as heart, liver, or tumor FABP3, FABP1, FFAR2 TSHR 717/4885CETP 396/4885FAAH 77/4885
US-20080213178-A1 Using a radiolabeled fatty acid analog such as endo-[18F] fluoro- or [123I]iodo-3,4-cyclopropylheptadecanoic acid localized in tissue of interest, imaging, determining blood flow rate FFAR3, FFAR2, FFAR1 TSHR 1155/4885CETP 473/4885FAAH 13/4885
US-20040253177-A1 Fatty acid derivatives; tissue-targeted therapy; tomography; cardiovascular disorders; liver disorders; kits FABP1, FABP3, FFAR2 TSHR 793/4885CETP 118/4885FAAH 69/4885
US-20090156848-A1 METHOD FOR MONITORING BLOOD FLOW AND METABOLIC UPTAKE IN TISSUE WITH RADIOLABELED ALKANOIC ACID FABP3, FABP1, SLC27A2 TSHR 1308/4885CETP 707/4885FAAH 66/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.