SCHEMBL875385

SCHEMBL875385

CCNc1nc(-c2ccc(NC(=O)c3cc4cccnc4s3)cc2)ccc1C(=O)NC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.40
KDM4E B2RXH2 5/20 0.40
HPGD P15428 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
HSD17B10 Q99714 3/20 0.40
CHRNA7 P36544 2/20 0.39
NPC1 O15118 5/20 0.37
RAB9A P51151 5/20 0.37
ATM Q13315 1/20 0.37
NAMPT P43490 1/20 0.37
ROCK1 Q13464 1/20 0.37
KCNH2 Q12809 3/20 0.36
CSF1R P07333 2/20 0.36
PDGFRA P16234 2/20 0.36
FLT4 P35916 2/20 0.36
FLT3 P36888 2/20 0.36
NTRK1 P04629 1/20 0.36
NTRK3 Q16288 1/20 0.36
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 2/20 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
SCHEMBL874210 0.91 MAPT (0.40) MAPTKDM4EHPGDSMN1; SMN2HSD17B10
SCHEMBL874082 0.90 MAPT (0.38) MAPTKDM4EHPGDSMN1; SMN2HSD17B10
SCHEMBL874570 0.88 MOK (0.43) MAPTKDM4EHPGDSMN1; SMN2HSD17B10
SCHEMBL874083 0.88 KDM4E (0.38) MAPTKDM4EHPGDSMN1; SMN2HSD17B10
SCHEMBL874837 0.88 KMT2A (0.37) MAPTKDM4EHPGDSMN1; SMN2HSD17B10
SCHEMBL874246 0.87 PDE4B (0.44) MAPTKDM4EHPGDSMN1; SMN2HSD17B10
SCHEMBL874571 0.86 MAPT (0.38) MAPTKDM4EHPGDSMN1; SMN2HSD17B10
SCHEMBL874300 0.86 MAPT (0.37) MAPTSMN1; SMN2NPC1RAB9AROCK1
SCHEMBL874686 0.84 CYP3A4 (0.42) CHRNA7NAMPTKCNH2NPSR1CYP3A4
SCHEMBL874025 0.84 NAMPT (0.41) MAPTKDM4EHPGDSMN1; SMN2HSD17B10

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
WO-2012038905-A1 THIENOPYRIDINE NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-03-29 WO disclosed