SCHEMBL7624645

SCHEMBL7624645

COc1ccc(=NN)n(C)n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.35
HIF1A Q16665 1/20 0.35
PTGS2 P35354 3/20 0.34
KDM4E B2RXH2 2/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PTGS1 P23219 1/20 0.32
NNMT P40261 2/20 0.32
DYRK3 O43781 2/20 0.31
DYRK1A Q13627 2/20 0.31
DYRK2 Q92630 2/20 0.31
DYRK1B Q9Y463 2/20 0.31
TSHR P16473 1/20 0.31
CCNA2 P20248 1/20 0.31
CDK2 P24941 1/20 0.31
CCNT1 O60563 1/20 0.31
CDK9 P50750 1/20 0.31
MKNK1 Q9BUB5 1/20 0.30
MKNK2 Q9HBH9 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL7612236 0.66 HTT (0.41) SMN1; SMN2KDM4EHSD17B10
Hydrochloric Acid SCHEMBL21597733 0.61 SMN1; SMN2 (0.34) SMN1; SMN2HIF1AKDM4EHPGDHSD17B10
SCHEMBL7644422 0.60 NNMT (0.32) NNMT
SCHEMBL28993058 0.60
SCHEMBL29795195 0.60 NNMT (0.54) SMN1; SMN2KDM4EHPGDHSD17B10NNMT
SCHEMBL353814 0.60 NNMT (0.54) SMN1; SMN2KDM4EHPGDHSD17B10NNMT
SCHEMBL15279084 0.59 LOXL2 (0.39) SMN1; SMN2HIF1A
SCHEMBL24760036 0.58
SCHEMBL21737415 0.58
SCHEMBL9953840 0.57 SMN1; SMN2 (0.37) SMN1; SMN2HIF1ANNMTTSHRMKNK1

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-2002074267-A1 NOVEL DYEING COMPOSITIONS FOR THE DYEING OF KERATIN FIBRES COMPRISING 6-MEMBERED HETEROCYCLIC HYDRAZONE COMPOUNDS AS AN OXIDATION BASE L'OREAL (FR) 2002-09-26 WO disclosed