SCHEMBL23601244

SCHEMBL23601244

CN(c1cccc(-c2ccc(C3(C)CCC3)nc2)c1)c1nc2nncn2c2cc(Cl)ccc12

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
MAT2A P31153 1/20 0.32
HRH4 Q9H3N8 1/20 0.31
CSNK2A2 P19784 1/20 0.31
CSNK2B P67870 1/20 0.31
MAPT P10636 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
SCHEMBL23577231 0.89 FNTA (0.32) FNTAFNTBHRH4
SCHEMBL29909216 0.89 FNTA (0.32) FNTAFNTBHRH4
SCHEMBL23576859 0.87 FNTA (0.33) FNTAFNTBMAT2AHRH4
SCHEMBL29909295 0.87 FNTA (0.33) FNTAFNTBMAT2AHRH4
SCHEMBL23601815 0.87 FNTA (0.33) FNTAFNTBHRH4
SCHEMBL23601243 0.85 ABCG2 (0.32)
SCHEMBL23577995 0.85 FNTA (0.37) FNTAFNTBMAT2ACSNK2A2CSNK2B
SCHEMBL29909557 0.85 FNTA (0.37) FNTAFNTBMAT2ACSNK2A2CSNK2B
SCHEMBL23576895 0.85 FNTA (0.37) FNTAFNTBMAT2ACSNK2A2CSNK2B
SCHEMBL23601442 0.84 NPC1 (0.38) FNTAFNTBMAT2ACSNK2A2CSNK2B

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-2021130638-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS CARNA BIOSCIENCES, INC. (JP) 2021-07-01 WO disclosed