SCHEMBL1329210

SCHEMBL1329210

CCc1cccc(CC)c1-c1cc(OC)c(CN(CCc2ccc(OC)cc2)Cc2ccccc2)cn1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BCHE P06276 15/20 0.53
L3MBTL1 Q9Y468 1/20 0.47
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
TP53 P04637 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL1328054 1.00 BCHE (0.53) BCHEL3MBTL1KDM4EALDH1A1TSHR
SCHEMBL1328695 0.95 BCHE (0.49) BCHEL3MBTL1KDM4EALDH1A1TSHR
SCHEMBL1328097 0.92 L3MBTL1 (0.47) BCHEL3MBTL1TP53
SCHEMBL1329445 0.91 L3MBTL1 (0.47) BCHEL3MBTL1TP53
SCHEMBL1327627 0.91 L3MBTL1 (0.47) BCHEL3MBTL1TP53
SCHEMBL1329732 0.91 BCHE (0.48) BCHEL3MBTL1
SCHEMBL1329875 0.89 BCHE (0.52) BCHE
SCHEMBL1328269 0.88 BCHE (0.47) BCHEL3MBTL1
SCHEMBL1329472 0.88 BCHE (0.47) BCHEKDM4EALDH1A1TSHR
SCHEMBL1329337 0.88 TSHR (0.42) BCHEL3MBTL1KDM4EALDH1A1TSHR

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 BCHE 3774/4885L3MBTL1 3202/4885KDM4E 2088/4885
US-20090176980-A1 3-Substituted-6-Aryl Pyridines C3AR1, C5AR1, C5AR2 BCHE 3774/4885L3MBTL1 3202/4885KDM4E 2088/4885

“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.