SCHEMBL1327009

SCHEMBL1327009

CCCC(Oc1cccnc1)c1cnc(-c2c(CC)cccc2CC)cc1OCC

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CCNC P24863 1/20 0.36
CDK8 P49336 1/20 0.36
GRM5 P41594 1/20 0.36
ALPL P05186 3/20 0.34
GPR132 Q9UNW8 3/20 0.34
GRM2 Q14416 1/20 0.34
LMNA P02545 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MKNK1 Q9BUB5 1/20 0.34
MKNK2 Q9HBH9 1/20 0.34
ALDH1A1 P00352 2/20 0.33
S1PR1 P21453 1/20 0.33
KMT2A Q03164 2/20 0.33
PDPK1 O15530 1/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 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
SCHEMBL1328050 0.89 KDM4C (0.33) LMNAL3MBTL1ALDH1A1KMT2ACYP3A4
SCHEMBL1327067 0.88 RXRA (0.35) LMNAL3MBTL1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL1326819 0.84 MAPK1 (0.36) GPR132L3MBTL1SMN1; SMN2ALDH1A1S1PR1
SCHEMBL2141478 0.84 ALDH1A1 (0.40) GPR132LMNAL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL1327217 0.84 KMT2A (0.44) SMN1; SMN2KMT2A
SCHEMBL1328704 0.82 PDE4D (0.33) GRM5LMNAL3MBTL1KMT2A
SCHEMBL1327155 0.82 CREBBP (0.38) L3MBTL1SMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL1328777 0.82 KCNB1 (0.36) L3MBTL1SMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL1327052 0.79 ABCB1 (0.33) LMNAL3MBTL1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL1328707 0.78 NPSR1 (0.38) LMNAL3MBTL1

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 CCNC 2978/4885CDK8 3369/4885GRM5 1027/4885
US-20090176980-A1 3-Substituted-6-Aryl Pyridines C3AR1, C5AR1, C5AR2 CCNC 2978/4885CDK8 3369/4885GRM5 1027/4885

“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.