SCHEMBL1383335

SCHEMBL1383335

CN(Cc1ccccc1)c1ncc(C(=O)NCCC(O)c2cccc(N)c2)c(-c2ccccc2)n1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CASR P41180 8/20 0.54
THRB P10828 2/20 0.41
RXFP1 Q9HBX9 3/20 0.40
RIPK1 Q13546 6/20 0.39

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
SCHEMBL1385867 0.92 CASR (0.59) CASRTHRBRXFP1RIPK1
SCHEMBL1385344 0.92 CASR (0.54) CASRTHRBRXFP1
SCHEMBL1383579 0.91 CASR (0.55) CASRTHRBRXFP1
SCHEMBL1386100 0.87 CASR (0.56) CASRTHRBRXFP1RIPK1
SCHEMBL1385847 0.86 CASR (0.55) CASRTHRBRIPK1
SCHEMBL1386625 0.85 CASR (0.59) CASRTHRBRIPK1
SCHEMBL1384253 0.85 CASR (0.51) CASRTHRB
SCHEMBL1383373 0.84 CASR (0.55) CASRTHRBRXFP1
SCHEMBL1383132 0.82 CASR (0.47) CASR
SCHEMBL1385726 0.81 CASR (0.46) CASRTHRBRXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4825686-B2 2011-11-30 JP claimed