SCHEMBL2911294

SCHEMBL2911294

Cc1nc(C)c(OC(=O)Nc2ccccc2-c2cc(F)c(F)cc2F)s1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 11/20 0.45
RAB9A P51151 6/20 0.39
NPC1 O15118 5/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
MAPT P10636 1/20 0.36
RECQL P46063 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
TP53 P04637 1/20 0.36
KDM4E B2RXH2 1/20 0.34
PKM P14618 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
SCHEMBL2905171 0.87 CHRM3 (0.42) CHRM3RAB9ANPC1NPSR1MEN1
SCHEMBL2906437 0.86 CHRM3 (0.46) CHRM3RAB9ANPC1NPSR1MEN1
SCHEMBL977511 0.81 RAB9A (0.55) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL2911519 0.74 CHRM3 (0.43) CHRM3RAB9ANPC1NPSR1MAPT
SCHEMBL978883 0.72 MAPT (0.47) CHRM3RAB9ANPC1MEN1KMT2A
SCHEMBL4599192 0.72 TSHR (0.44) RAB9ANPC1NPSR1MEN1KMT2A
SCHEMBL16438663 0.72 CHRM3 (0.47) CHRM3RAB9ANPC1NPSR1MEN1
SCHEMBL1024112 0.72 CHRM3 (0.40) CHRM3RAB9ANPC1NPSR1MEN1
SCHEMBL4602463 0.71 NPC1 (0.47) CHRM3RAB9ANPC1NPSR1MEN1
SCHEMBL2784708 0.70 F2 (0.41) RAB9ANPC1MAPTRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1888545-B1 THIAZOLE CARBOXYLIC ACID ANILIDES BASF SE (DE) 2010-08-25 EP claimed
EP-1888545-A1 THIAZOLE CARBOXYLIC ACID ANILIDES BASF AKTIENGESELLSCHAFT (DE) 2008-02-20 EP claimed
WO-2006122933-A1 THIAZOLE CARBOXYLIC ACID ANILIDES BASF AKTIENGESELLSCHAFT (DE) 2006-11-23 WO claimed
EP-1888545-B1 THIAZOLE CARBOXYLIC ACID ANILIDES BASF SE (DE) 2010-08-25 EP disclosed
EP-1888545-A1 THIAZOLE CARBOXYLIC ACID ANILIDES BASF AKTIENGESELLSCHAFT (DE) 2008-02-20 EP disclosed
WO-2006122933-A1 THIAZOLE CARBOXYLIC ACID ANILIDES BASF AKTIENGESELLSCHAFT (DE) 2006-11-23 WO disclosed