SCHEMBL1330574

SCHEMBL1330574

CCc1cccc(CC)c1-c1cc(Oc2ccc(C(N)=O)c(O)c2)c(CN(CC)CCOC)c(C)n1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOB P27338 12/20 0.38
SCN9A Q15858 4/20 0.38
KDR P35968 1/20 0.36
APP P05067 6/20 0.35
MAOA P21397 4/20 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
SCHEMBL1328782 0.84 CRHR1 (0.34) SCN9A
SCHEMBL1328007 0.82 PARP10 (0.37) SCN9AKDR
SCHEMBL1329118 0.80 C5AR1 (0.36) SCN9A
SCHEMBL1328878 0.78 SCN9A (0.41) MAOBSCN9A
SCHEMBL1327736 0.76 SCN9A (0.34) MAOBSCN9AMAOA
SCHEMBL1327260 0.76 LMNA (0.34) MAOBSCN9AMAOA
SCHEMBL1327910 0.76 SCN9A (0.43) SCN9A
SCHEMBL1329213 0.76 LMNA (0.34) MAOBSCN9AMAOA
SCHEMBL1328533 0.76 SCN9A (0.42) SCN9A
SCHEMBL1327264 0.76 LMNA (0.34) MAOBSCN9AMAOA

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 MAOB 588/4885SCN9A 1307/4885KDR 327/4885
US-20090176980-A1 3-Substituted-6-Aryl Pyridines C3AR1, C5AR1, C5AR2 MAOB 588/4885SCN9A 1307/4885KDR 327/4885

“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.