SCHEMBL1329557

SCHEMBL1329557

CCc1cccc(CC)c1-c1nc(C)c(COc2cc(C)c(Cl)c(C)c2)c(OC)c1C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.38
MAPT P10636 1/20 0.36
LMNA P02545 2/20 0.36
KDM4E B2RXH2 2/20 0.35
HPGD P15428 2/20 0.35
FGFR4 P22455 3/20 0.35
NR1H4 Q96RI1 2/20 0.34
CD274 Q9NZQ7 1/20 0.34
PIK3CD O00329 2/20 0.33
TP53 P04637 1/20 0.33
BCL2 P10415 2/20 0.33
MCL1 Q07820 2/20 0.33

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
SCHEMBL1329216 0.92 CD274 (0.33) KDM4ENR1H4CD274
SCHEMBL1328302 0.88 MAPT (0.38) POLBMAPTKDM4ETP53
SCHEMBL1327226 0.88 CD274 (0.33) MAPTKDM4ECD274
SCHEMBL1329949 0.86 L3MBTL1 (0.37) POLBMAPTLMNAKDM4EHPGD
SCHEMBL1329444 0.85 KCNH2 (0.36) POLBMAPTLMNAHPGDNR1H4
SCHEMBL1327657 0.85 MEN1 (0.38) MAPTLMNAKDM4EHPGDCD274
SCHEMBL1328502 0.84 KDM4E (0.39) POLBMRGPRX4MAPTLMNAKDM4E
SCHEMBL1328324 0.84 PPARG (0.36) MAPTLMNAHPGDNR1H4PIK3CD
SCHEMBL1329202 0.83 RAB9A (0.37) POLBMAPTLMNAKDM4EHPGD
SCHEMBL1328554 0.82 MAOB (0.37) MAPTLMNAKDM4EHPGDCD274

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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 POLB 4733/4885MRGPRX4 30/4885MAPT 4726/4885
US-20090176980-A1 3-Substituted-6-Aryl Pyridines C3AR1, C5AR1, C5AR2 POLB 4733/4885MRGPRX4 30/4885MAPT 4726/4885

“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.