SCHEMBL1329240

SCHEMBL1329240

CCc1cccc(CC)c1-c1ccc(COc2ccc(Cl)c(F)c2)c(C)n1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 12/20 0.41
PPARG P37231 3/20 0.39
FFAR4 Q5NUL3 1/20 0.38
SCN9A Q15858 1/20 0.36
MAOB P27338 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
MAPT P10636 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
SCHEMBL1329779 0.85 PPARG (0.38) FFAR1PPARGFFAR4
SCHEMBL1327712 0.83 C5AR1 (0.43) PPARGMAPT
SCHEMBL1328775 0.82 POLB (0.41) FFAR1FFAR4MAPT
SCHEMBL1329430 0.82 ALOX5 (0.42) FFAR1MAPT
SCHEMBL1328898 0.81 BRD4 (0.40) FFAR1PPARGMAOBMAPT
SCHEMBL1329873 0.81 C5AR1 (0.36) FFAR1PPARGMAOBMAPT
SCHEMBL1327358 0.80 PTGER1 (0.45)
SCHEMBL1327230 0.80 FFAR1 (0.35) FFAR1FFAR4MAOBMAPT
SCHEMBL1327752 0.80 RXFP1 (0.35) FFAR1MAPT
SCHEMBL1328003 0.78 PARP10 (0.43) PPARGMAPT

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 FFAR1 108/4885PPARG 1440/4885FFAR4 138/4885
US-20090176980-A1 3-Substituted-6-Aryl Pyridines C3AR1, C5AR1, C5AR2 FFAR1 108/4885PPARG 1440/4885FFAR4 138/4885

“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.