SCHEMBL1470342

SCHEMBL1470342

C=CCC(C(=C)C(=O)O)N1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.39
SLC6A2 P23975 2/20 0.38
SLC6A3 Q01959 2/20 0.38
POLB P06746 1/20 0.37
MAPK1 P28482 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SLC6A4 P31645 1/20 0.35
NPSR1 Q6W5P4 2/20 0.35
ALDH1A1 P00352 3/20 0.33
RAB9A P51151 2/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 2/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
GLA P06280 1/20 0.32
TSHR P16473 1/20 0.30

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
SCHEMBL1128614 0.80 ALDH1A1 (0.41) HSD17B10POLBMAPK1L3MBTL1NPSR1
SCHEMBL5799734 0.70 ALDH1A1 (0.41) HSD17B10MAPK1NPSR1ALDH1A1RAB9A
SCHEMBL28108702 0.69 HSD17B10 (0.50) HSD17B10POLBMAPK1L3MBTL1NPSR1
SCHEMBL170764 0.66 KMT2A (0.38) NPSR1ALDH1A1RAB9AMAPTLMNA
SCHEMBL4625385 0.66 SIGMAR1 (0.36) SLC6A2SLC6A3POLBSLC6A4ALDH1A1
SCHEMBL11797800 0.66 ALDH1A1 (0.41) HSD17B10POLBMAPK1L3MBTL1NPSR1
SCHEMBL7201421 0.66 HSD17B10 (0.50) HSD17B10POLBMAPK1L3MBTL1NPSR1
SCHEMBL24550941 0.65 HSD17B10 (0.53) HSD17B10POLBMAPK1L3MBTL1NPSR1
SCHEMBL1502272 0.65 HSD17B10 (0.41) HSD17B10POLBMAPK1NPSR1ALDH1A1
SCHEMBL997678 0.65 HSD17B10 (0.53) HSD17B10POLBMAPK1L3MBTL1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9150670-B2 Near-infrared absorptive dye-containing curable composition, ink composition and method of producing near-infrared absorptive filter FUJIFILM CORPORATION (JP) 2015-10-06 US disclosed
US-8691739-B2 Lubricating oil composition EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2014-04-08 US disclosed
US-20120140005-A1 INKJET PRINTING METHODS AND INKJET INK SETS AGFA GRAPHICS NV (BE) 2012-06-07 US disclosed
US-20110070407-A1 NEAR-INFRARED ABSORPTIVE DYE-CONTAINING CURABLE COMPOSITION, INK COMPOSITION AND METHOD OF PRODUCING NEAR-INFRARED ABSORPTIVE FILTER FUJIFILM CORPORATION (JP) 2011-03-24 US disclosed
EP-1828277-A1 RADIATION CURABLE COATING COMPOSITION DSMIP Assets B.V. (NL) 2007-09-05 EP disclosed
US-20070032392-A1 Lubricating oil composition YOKOYAMA YASUHARU 2007-02-08 US disclosed
EP-1749876-A2 Lubricating oil composition containing a polymethacrylate VI improver TonenGeneral Sekiyu Kabushiki Kaisha (JP) 2007-02-07 EP disclosed
WO-2006041289-A1 RADIATION CURABLE COATING COMPOSITION DSM IP ASSETS B.V. (NL) 2006-04-20 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 (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-20110070407-A1 NEAR-INFRARED ABSORPTIVE DYE-CONTAINING CURABLE COMPOSITION, INK COMPOSITION AND METHOD OF PRODUCING NEAR-INFRARED ABSORPTIVE FILTER RB1, IK, STRA6 HSD17B10 2990/4885SLC6A2 1380/4885SLC6A3 1330/4885

“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.