SCHEMBL29909098

SCHEMBL29909098

CN(c1cccc(-c2ccc(C#N)c(Cl)c2)c1)c1nc2nncn2c2cc(Cl)c(F)cc12

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 5/20 0.37
CYP11B1 P15538 3/20 0.36
ABCG2 Q9UNQ0 1/20 0.32
EGLN2 Q96KS0 1/20 0.32
MCHR1 Q99705 1/20 0.31
PGR P06401 5/20 0.31
FASN P49327 1/20 0.31
CYP2C19 P33261 1/20 0.31
EED O75530 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
SCHEMBL23577385 0.85 ABCG2 (0.34) ABCG2EGLN2MCHR1CYP2C19
SCHEMBL29909937 0.84 PIK3C2A (0.32)
SCHEMBL23601304 0.84 PIK3C2A (0.32)
SCHEMBL29909794 0.84 FNTA (0.34) ABCG2
SCHEMBL23601029 0.84 FNTA (0.34) ABCG2
SCHEMBL23577166 0.84 FNTA (0.34) ABCG2
SCHEMBL23578114 0.83 PTGS2 (0.36)
SCHEMBL29909818 0.83 MAP4K4 (0.36) ABCG2
SCHEMBL23576626 0.83 MAP4K4 (0.36) ABCG2
SCHEMBL23577201 0.82 ABCG2 (0.35) ABCG2

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
CN-118324767-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2024-07-12 CN disclosed
EP-4081305-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2022-11-02 EP disclosed