SCHEMBL29909557

SCHEMBL29909557

CN(c1cccc(-c2ccc(F)nc2)c1)c1nc2nncn2c2cc(Cl)ccc12

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.36
CNR1 P21554 1/20 0.34
GRIN2B Q13224 1/20 0.33
DHODH Q02127 1/20 0.32
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
TP53 P04637 2/20 0.32
MAPT P10636 2/20 0.32
MAT2A P31153 7/20 0.32
PRMT5 O14744 4/20 0.32
CYP1A2 P05177 1/20 0.32
GRM4 Q14833 1/20 0.31
CSF1R P07333 1/20 0.31
CYP3A4 P08684 1/20 0.31
POLB P06746 1/20 0.31
CYP11B2 P19099 1/20 0.31

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
SCHEMBL23576895 1.00 FNTA (0.37) FNTAFNTBABCG2CNR1GRIN2B
SCHEMBL23577995 0.91 FNTA (0.37) FNTAFNTBABCG2CSNK2A2CSNK2B
SCHEMBL23601338 0.90 FNTA (0.35) FNTAFNTBABCG2CSNK2A2CSNK2B
SCHEMBL23601442 0.90 NPC1 (0.38) FNTAFNTBABCG2GRIN2BCSNK2A2
SCHEMBL31229464 0.90 NPC1 (0.38) FNTAFNTBABCG2GRIN2BCSNK2A2
SCHEMBL31169421 0.89 FNTA (0.36) FNTAFNTBABCG2
SCHEMBL23601434 0.89 FNTA (0.36) FNTAFNTBABCG2
SCHEMBL23601435 0.89 FNTA (0.35) FNTAFNTBABCG2CSNK2A2CSNK2B
SCHEMBL23601235 0.89 FNTA (0.40) FNTAFNTBABCG2CSNK2A2CSNK2B
SCHEMBL29909768 0.89 FNTA (0.40) FNTAFNTBABCG2CSNK2A2CSNK2B

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