SCHEMBL7140177

SCHEMBL7140177

CCCCCCCCCCCC(CCO)OCc1ccc(OC)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 4/20 0.43
HDAC2 Q92769 2/20 0.42
MMP9 P14780 6/20 0.41
MMP13 P45452 6/20 0.41
ADAM17 P78536 4/20 0.41
MMP1 P03956 4/20 0.41
CALM1 P0DP23 1/20 0.41
MMP2 P08253 3/20 0.40
IDO1 P14902 2/20 0.40
AGXT P21549 2/20 0.40
MMP3 P08254 1/20 0.40
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40

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
SCHEMBL13030081 1.00 TBXAS1 (0.43) TBXAS1HDAC2MMP9MMP13ADAM17
SCHEMBL7140172 1.00 TBXAS1 (0.43) TBXAS1HDAC2MMP9MMP13ADAM17
SCHEMBL13030124 0.91 TBXAS1 (0.43) TBXAS1HDAC2MMP9MMP13ADAM17
SCHEMBL29193293 0.91 TBXAS1 (0.43) TBXAS1HDAC2MMP9MMP13ADAM17
SCHEMBL29193294 0.91 TBXAS1 (0.43) TBXAS1HDAC2MMP9MMP13ADAM17
SCHEMBL1360010 0.84 MMP9 (0.53) TBXAS1HDAC2MMP9MMP13ADAM17
SCHEMBL1358444 0.84 MMP9 (0.53) TBXAS1HDAC2MMP9MMP13ADAM17
SCHEMBL2638976 0.84 MMP9 (0.53) TBXAS1HDAC2MMP9MMP13ADAM17
SCHEMBL1359555 0.84 MMP9 (0.53) TBXAS1HDAC2MMP9MMP13ADAM17
SCHEMBL16829844 0.84 CETP (0.47)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6511965-B2 For therapy and prophylaxis of inflammatory disorders, autoimmune diseases or septicemia SANKYO COMPANY, LIMITED (JP) 2003-01-28 US disclosed
US-20020161221-A1 Ether type lipid a 1-carboxylic acid analogs SANKYO COMPANY, LIMITED (JP) 2002-10-31 US disclosed
EP-1152007-A1 ETHER TYPE LIPID A1-CARBOXYLIC ACID ANALOGUES Sankyo Company, Limited (JP) 2001-11-07 EP 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 (1 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-20020161221-A1 Ether type lipid a 1-carboxylic acid analogs MSR1, ELOVL1, FFAR1 TBXAS1 1071/4885HDAC2 394/4885MMP9 4394/4885

“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.