SCHEMBL2139013

SCHEMBL2139013

CCc1cccc(CC)c1-c1nc(C)c(CN(C)Cc2ccccc2)c(OC)c1C

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
POLB P06746 1/20 0.43
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
ACHE P22303 5/20 0.37
CRHR1 P34998 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 3/20 0.35
HSD17B10 Q99714 1/20 0.35
BCHE P06276 2/20 0.34
MEN1 O00255 1/20 0.34
MMP13 P45452 1/20 0.34

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
SCHEMBL2138370 0.90 MEN1 (0.43) SMN1; SMN2POLBKDM4EALDH1A1ACHE
SCHEMBL1329399 0.89 ATM (0.41) SMN1; SMN2KDM4EACHEMAPT
SCHEMBL1328327 0.87 MEN1 (0.40) SMN1; SMN2KDM4EALDH1A1GAAMAPT
SCHEMBL1328362 0.87 ALDH1A1 (0.33) SMN1; SMN2POLBALDH1A1CRHR1GAA
SCHEMBL1328114 0.86 CRHR1 (0.33) SMN1; SMN2POLBCRHR1TSHRKMT2A
SCHEMBL1329703 0.85 P2RX7 (0.35) SMN1; SMN2KDM4EALDH1A1ACHEGAA
SCHEMBL1327491 0.84 BCHE (0.38) CRHR1MAPTBCHE
SCHEMBL1327840 0.82 PDCD1LG2 (0.35) SMN1; SMN2KDM4EALDH1A1ACHECRHR1
SCHEMBL1327565 0.82 L3MBTL1 (0.35) KMT2AMEN1
SCHEMBL1329151 0.81 POLB (0.46) SMN1; SMN2POLBKDM4EALDH1A1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (1 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-20090176980-A1 3-Substituted-6-Aryl Pyridines C3AR1, C5AR1, C5AR2 SMN1; SMN2 4559/4885POLB 4733/4885KDM4E 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.