SCHEMBL874246

SCHEMBL874246

CCNc1nc(-c2ccc(NC(=O)c3cc4cccnc4s3)cc2)ncc1C(=O)NC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.44
CHRNA7 P36544 2/20 0.38
MAPT P10636 6/20 0.37
LMNA P02545 5/20 0.37
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
CYP1A2 P05177 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
NPC1 O15118 6/20 0.37
RAB9A P51151 6/20 0.37
KDM4E B2RXH2 4/20 0.37
ATM Q13315 1/20 0.36
NAMPT P43490 1/20 0.36
ALDH1A1 P00352 2/20 0.36
POLB P06746 3/20 0.35
RXFP1 Q9HBX9 2/20 0.35
PPARG P37231 1/20 0.35
NCOA2 Q15596 1/20 0.35
TRPV1 Q8NER1 2/20 0.35

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
SCHEMBL875385 0.87 MAPT (0.40) CHRNA7MAPTLMNAMEN1KMT2A
SCHEMBL874210 0.78 MAPT (0.40) CHRNA7MAPTMEN1KMT2ANPC1
SCHEMBL874082 0.77 MAPT (0.38) CHRNA7MAPTMEN1KMT2ACYP2C9
SCHEMBL874083 0.77 KDM4E (0.38) CHRNA7MAPTLMNAMEN1KMT2A
SCHEMBL874570 0.76 MOK (0.43) CHRNA7MAPTMEN1KMT2ANPC1
SCHEMBL874571 0.75 MAPT (0.38) CHRNA7MAPTLMNAMEN1KMT2A
SCHEMBL874837 0.75 KMT2A (0.37) CHRNA7MAPTKMT2ACYP2C9NPC1
SCHEMBL3050177 0.74 POLB (0.55) MEN1KMT2ANAMPTALDH1A1POLB
SCHEMBL874339 0.74 MKNK1 (0.39) CHRNA7MAPTNPC1RAB9AKDM4E
SCHEMBL874300 0.73 MAPT (0.37) MAPTLMNAMEN1KMT2ACYP2C9

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