SCHEMBL21653136

SCHEMBL21653136

CCn1cc(NC(=O)c2cc(Cl)c(Cl)s2)cc(OC)c1=O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ MAPT P10636 5/20 0.45
▸ TP53 P04637 2/20 0.45
▸ PDE10A Q9Y233 9/20 0.44
▸ RAB9A P51151 2/20 0.42
▸ RECQL P46063 1/20 0.41
▸ CTDSP1 Q9GZU7 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.39
▸ CREBBP Q92793 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ NPC1 O15118 1/20 0.38

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
SCHEMBL21653252 0.89 SMN1; SMN2 (0.39) SMN1; SMN2MAPTTP53PDE10ARAB9A
SCHEMBL21653120 0.87 GSK3B (0.39) SMN1; SMN2MAPTTP53PDE10ARAB9A
SCHEMBL21653084 0.85 MAPT (0.39) SMN1; SMN2MAPTTP53PDE10ARAB9A
SCHEMBL21653251 0.85 GSK3B (0.38) SMN1; SMN2MAPTTP53PDE10ARAB9A
SCHEMBL21653245 0.85 USP7 (0.38) SMN1; SMN2MAPTTP53PDE10AKDM4E
SCHEMBL21653156 0.84 PDE10A (0.38) SMN1; SMN2MAPTTP53PDE10ARAB9A
SCHEMBL21653150 0.83 GSK3B (0.36) SMN1; SMN2MAPTTP53PDE10AKDM4E
SCHEMBL21653138 0.82 MAPT (0.39) SMN1; SMN2MAPTTP53PDE10AKDM4E
SCHEMBL21653145 0.82 GSK3B (0.35) SMN1; SMN2MAPTTP53PDE10AALDH1A1
SCHEMBL21652873 0.82 GSK3B (0.35) SMN1; SMN2MAPTTP53PDE10AALDH1A1

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-2020023657-A1 PYRIDIN-2-ONE COMPOUNDS USEFUL AS SMARCA2 ANTAGONISTS Epizyme, Inc. (US) 2020-01-30 — — WO disclosed
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