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SCHEMBL29909115

SCHEMBL29909115

CN(c1cccc(-c2ccc(C(C)(C)C)cc2)c1)c1nc2nncn2c2cc(Cl)cc(F)c12

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 1/20 0.35
▸ FNTB P49356 1/20 0.35
▸ ABCG2 Q9UNQ0 1/20 0.32
▸ DHODH Q02127 1/20 0.31
▸ TP53 P04637 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ CNR1 P21554 1/20 0.30
▸ OPRD1 P41143 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
SCHEMBL23577661 1.00 FNTA (0.35) FNTAFNTBABCG2DHODHTP53
SCHEMBL23577359 0.86 ABCG2 (0.32) FNTAFNTBABCG2DHODH
SCHEMBL29909922 0.85 FNTA (0.41) FNTAFNTBTP53MAPTCNR1
SCHEMBL23577059 0.85 FNTA (0.41) FNTAFNTBTP53MAPTCNR1
SCHEMBL29909794 0.85 FNTA (0.34) FNTAFNTBABCG2DHODHOPRD1
SCHEMBL23577166 0.85 FNTA (0.34) FNTAFNTBABCG2DHODHOPRD1
SCHEMBL29909506 0.84 ABCG2 (0.35) FNTAFNTBABCG2DHODHTP53
SCHEMBL23577238 0.84 ABCG2 (0.35) FNTAFNTBABCG2DHODHTP53
SCHEMBL23601386 0.82 EGFR (0.34) FNTAFNTBABCG2TP53MAPT
SCHEMBL23576887 0.82 DHODH (0.40) FNTAFNTBABCG2DHODHTP53

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
EP-4081305-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2022-11-02 — — EP disclosed
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