SCHEMBL1329153

SCHEMBL1329153

CCc1cccc(CC)c1-c1cc(Oc2ccc(C(N)=O)c(O)c2)c(CN2CCC(C(=O)O)CC2)c(C)n1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 3/20 0.37
S1PR5 Q9H228 7/20 0.37
LTA4H P09960 2/20 0.37
CCR8 P51685 2/20 0.37
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 2/20 0.35
S1PR1 P21453 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
ENPP2 Q13822 2/20 0.35
PDCD1 Q15116 1/20 0.35

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
SCHEMBL1327342 0.92 ALDH1A1 (0.45) CCR8ALDH1A1HSD17B10KDM4EMAPT
SCHEMBL2141460 0.92 LMNA (0.34) ALDH1A1MAPTMAPK1
SCHEMBL1328878 0.90 SCN9A (0.41) CD274KDM4E
SCHEMBL1327910 0.88 SCN9A (0.43) ALDH1A1HSD17B10KDM4EMAPK1
SCHEMBL1327736 0.88 SCN9A (0.34)
SCHEMBL1330011 0.87 CD274 (0.36) CD274LTA4HALDH1A1KDM4EMAPT
SCHEMBL1328814 0.87 SCN9A (0.36) KDM4E
SCHEMBL1330327 0.87 SOS1 (0.36) ALDH1A1KDM4E
SCHEMBL1327264 0.86 LMNA (0.34) S1PR1MAPT
SCHEMBL1327260 0.86 LMNA (0.34) S1PR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110281837-A1 3-SUBSTITUTED-6-ARYL PYRIDINES HUTCHINSON ALAN J (US) 2011-11-17 US disclosed
US-7863454-B2 3-substituted-6-aryl pyridines NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2011-01-04 US disclosed
US-20090176980-A1 3-Substituted-6-Aryl Pyridines NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2009-07-09 US disclosed
US-7342115-B2 Binding antagonist and arylpyridine for antiinflammatory agents, cardiovascular disorders and antagonist or agonist and for immunology NEUROGEN CORPORATION (US) 2008-03-11 US 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 (2 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-20110281837-A1 3-SUBSTITUTED-6-ARYL PYRIDINES C3AR1, C5AR1, C5AR2 CD274 1147/4885S1PR5 224/4885LTA4H 487/4885
US-20090176980-A1 3-Substituted-6-Aryl Pyridines C3AR1, C5AR1, C5AR2 CD274 1147/4885S1PR5 224/4885LTA4H 487/4885

“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.