SCHEMBL9710950

SCHEMBL9710950

CCn1c(C#N)c(C#N)n(-c2ccc(Cl)cc2)c1=O

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.40
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
POLB P06746 2/20 0.39
ALDH1A1 P00352 2/20 0.38
MAPT P10636 1/20 0.38
AR P10275 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
ELANE P08246 2/20 0.37
MAPK8 P45983 1/20 0.36
PGR P06401 1/20 0.36
MGLL Q99685 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
ADORA2A P29274 1/20 0.34
ADORA1 P30542 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
SCHEMBL9710635 0.90 ALDH1A1 (0.40) NPC1GSK3AGSK3BPOLBALDH1A1
SCHEMBL9710714 0.88 NPC1 (0.49) NPC1GSK3AGSK3BPOLBALDH1A1
SCHEMBL9710744 0.85 GSK3A (0.40) GSK3AGSK3BPOLBMAPTAR
SCHEMBL9710821 0.85 POLB (0.38) NPC1GSK3AGSK3BPOLBALDH1A1
SCHEMBL9710718 0.82 L3MBTL1 (0.35) NPC1GSK3AGSK3BPOLBALDH1A1
SCHEMBL9710842 0.81 RGS4 (0.50) POLBALDH1A1ARKMT2AKDM4E
SCHEMBL9710822 0.80 GSK3A (0.50) GSK3AGSK3BPOLBALDH1A1MAPT
SCHEMBL9711093 0.78 GSK3A (0.37) GSK3AGSK3BPOLBALDH1A1MAPT
SCHEMBL9710615 0.78 NPC1 (0.48) NPC1GSK3AGSK3BPOLBALDH1A1
SCHEMBL9710917 0.78 TDP2 (0.43) NPC1GSK3AGSK3BPOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992021662-A1 POSSIBLY CONDENSED PHENYLIMIDAZOLONES AND PYRIMIDINONES AS HERBICIDES; INTERMEDIATES DOWELANCO (US) 1992-12-10 WO disclosed
US-5153316-A Post and preemergence herbicides DOWELANCO 1992-10-06 US disclosed