SCHEMBL7616331

SCHEMBL7616331

NC1=NNC(=O)/C1=N/Nc1cccc(F)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DEPTOR Q8TB45 1/20 0.51
TAAR1 Q96RJ0 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
NOS1 P29475 1/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
STK10 O94804 2/20 0.34
SLK Q9H2G2 2/20 0.34
BRAF P15056 1/20 0.33
IDO1 P14902 1/20 0.33
HTR2B P41595 1/20 0.33
GRM5 P41594 1/20 0.33
CNR1 P21554 1/20 0.33
AKT1 P31749 1/20 0.33
EGFR P00533 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL7616338 1.00 DEPTOR (0.51) DEPTORTAAR1MEN1KMT2ANOS1
SCHEMBL26512340 0.84 DEPTOR (0.51) DEPTORTAAR1MEN1KMT2ANOS1
SCHEMBL26512521 0.84 DEPTOR (0.51) DEPTORTAAR1MEN1KMT2ANOS1
SCHEMBL26513756 0.82 DEPTOR (0.49) DEPTORTAAR1MEN1KMT2ANOS1
SCHEMBL922086 0.78 DEPTOR (0.61) DEPTORTAAR1MEN1KMT2ANOS1
SCHEMBL26512485 0.75 MAPT (0.34) KMT2AKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL6637470 0.72 DEPTOR (0.54) DEPTORTAAR1MEN1KMT2ANOS1
SCHEMBL6479468 0.71 DEPTOR (0.49) DEPTORTAAR1MEN1KMT2ANPC1
SCHEMBL922322 0.70 DEPTOR (0.51) DEPTORTAAR1MEN1KMT2ANOS1
SCHEMBL922321 0.70 DEPTOR (0.51) DEPTORTAAR1MEN1KMT2ANOS1

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
US-6436915-B1 ANTIPROLIFERATIVE AND ANTITUMOR AGENTS AND ANGIOGENESIS INHIBITORS KINETEK PHARMACEUTICALS, INC. (CA) 2002-08-20 US disclosed