SCHEMBL21653120

SCHEMBL21653120

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

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 1/20 0.39
▸ DAO P14920 1/20 0.39
▸ MAPT P10636 6/20 0.38
▸ TP53 P04637 1/20 0.38
▸ RXFP1 Q9HBX9 2/20 0.37
▸ PDE10A Q9Y233 4/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ MEN1 O00255 4/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ RAB9A P51151 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ USP2 O75604 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
SCHEMBL21653084 0.90 MAPT (0.39) GSK3BDAOMAPTTP53PDE10A
SCHEMBL21653251 0.90 GSK3B (0.38) GSK3BDAOMAPTTP53RXFP1
SCHEMBL21653156 0.89 PDE10A (0.38) GSK3BDAOMAPTTP53RXFP1
SCHEMBL21653150 0.88 GSK3B (0.36) GSK3BDAOMAPTTP53RXFP1
SCHEMBL21653136 0.87 SMN1; SMN2 (0.47) MAPTTP53PDE10ASMN1; SMN2RAB9A
SCHEMBL21653145 0.87 GSK3B (0.35) GSK3BDAOMAPTTP53RXFP1
SCHEMBL21653138 0.87 MAPT (0.39) GSK3BDAOMAPTTP53RXFP1
SCHEMBL21652873 0.87 GSK3B (0.35) GSK3BDAOMAPTTP53RXFP1
SCHEMBL21653072 0.87 KMT2A (0.38) GSK3BDAOMAPTRXFP1MEN1
SCHEMBL21653276 0.86 L3MBTL1 (0.36) GSK3BDAOMAPTTP53PDE10A

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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