SCHEMBL5260794

SCHEMBL5260794

CC(c1ccc(Cl)cc1)C(CNC(=O)c1ccc(-c2ccccc2N)cc1)c1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
F10 P00742 1/20 0.45
GPR139 Q6DWJ6 1/20 0.44
CYP27B1 O15528 2/20 0.42
CYP24A1 Q07973 2/20 0.42
SLC6A9 P48067 1/20 0.42
SLC6A5 Q9Y345 1/20 0.42
KDM4E B2RXH2 1/20 0.42
PRCP P42785 1/20 0.41
HDAC3 O15379 2/20 0.41
UTS2R Q9UKP6 5/20 0.40
HDAC1 Q13547 1/20 0.40
TP53 P04637 1/20 0.40
GCG P01275 1/20 0.40

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
SCHEMBL5261394 0.87 SMN1; SMN2 (0.48) MEN1RAB9AKMT2ASMN1; SMN2GPR139
SCHEMBL5260012 0.86 UTS2R (0.53) MEN1RAB9AKMT2ASMN1; SMN2GPR139
SCHEMBL5263124 0.85 MEN1 (0.44) MEN1RAB9AKMT2ASMN1; SMN2GPR139
SCHEMBL5266049 0.84 RAB9A (0.60) MEN1RAB9AKMT2ASMN1; SMN2GPR139
SCHEMBL5262774 0.83 SLC6A9 (0.54) MEN1RAB9AKMT2ASMN1; SMN2GPR139
SCHEMBL5260787 0.78 CNR1 (0.55)
SCHEMBL5262488 0.77 SLC6A9 (0.55) MEN1RAB9AKMT2ASMN1; SMN2GPR139
SCHEMBL5373381 0.77 UTS2R (0.55) MEN1RAB9AKMT2ASMN1; SMN2UTS2R
SCHEMBL5262392 0.76 SLC6A9 (0.53) MEN1RAB9AKMT2ASMN1; SMN2CYP27B1
SCHEMBL5261739 0.75 NPC1 (0.61) RAB9AGPR139

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1494997-A4 SUBSTITUTED ARYL AMIDES MERCK & CO INC (US) 2007-04-11 EP claimed
JP-2005527586-A 2005-09-15 JP claimed
EP-1494997-A1 SUBSTITUTED ARYL AMIDES Merck & Co., Inc. (US) 2005-01-12 EP claimed
WO-2003087037-A1 SUBSTITUTED ARYL AMIDES MERCK & CO., INC. (US) 2003-10-23 WO claimed
EP-1494997-A4 SUBSTITUTED ARYL AMIDES MERCK & CO INC (US) 2007-04-11 EP disclosed
EP-1494997-A1 SUBSTITUTED ARYL AMIDES Merck & Co., Inc. (US) 2005-01-12 EP disclosed
WO-2003087037-A1 SUBSTITUTED ARYL AMIDES MERCK & CO., INC. (US) 2003-10-23 WO disclosed