SCHEMBL1384191

SCHEMBL1384191

CC(CNC(=O)c1cnc(N(C)Cc2ccccc2)nc1-c1ccccc1)C(O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CASR P41180 8/20 0.55
THRB P10828 2/20 0.45
RXFP1 Q9HBX9 3/20 0.41
MAPT P10636 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ACACB O00763 1/20 0.37
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
RPS6KB1 P23443 1/20 0.36

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
SCHEMBL1384551 0.88 CASR (0.46) CASRKMT2A
SCHEMBL1385867 0.85 CASR (0.59) CASRTHRBRXFP1MAPTMEN1
SCHEMBL1383520 0.82 THRB (0.52) CASRTHRBRXFP1
SCHEMBL1386100 0.80 CASR (0.56) CASRTHRBRXFP1
SCHEMBL1383335 0.79 CASR (0.54) CASRTHRBRXFP1
SCHEMBL1385344 0.79 CASR (0.54) CASRTHRBRXFP1
SCHEMBL1385847 0.79 CASR (0.55) CASRTHRBLMNA
SCHEMBL1383579 0.79 CASR (0.55) CASRTHRBRXFP1
SCHEMBL3443236 0.79 CASR (0.55) CASRTHRBRXFP1MAPTMEN1
SCHEMBL1386625 0.78 CASR (0.59) CASRTHRBMAPT

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