SCHEMBL29909204

SCHEMBL29909204

CN(c1cccc(-c2ccc(C(C)(C)C(F)(F)F)cc2)c1)c1nc2nnc(Cl)n2c2ccccc12

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.35
PDE5A O76074 2/20 0.33
DHODH Q02127 1/20 0.32

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
SCHEMBL29909829 0.93 ABCG2 (0.36) ABCG2PDE5ADHODH
SCHEMBL29909024 0.92 ABCG2 (0.37) ABCG2PDE5ADHODH
SCHEMBL29909441 0.86 ABCG2 (0.34) ABCG2PDE5ADHODH
SCHEMBL29909758 0.85 ABCG2 (0.37) ABCG2PDE5ADHODH
SCHEMBL29909118 0.84 ABCG2 (0.36) ABCG2PDE5ADHODH
SCHEMBL29909643 0.84 ABCG2 (0.37) ABCG2PDE5ADHODH
SCHEMBL29909607 0.84 ABCG2 (0.34) ABCG2PDE5ADHODH
SCHEMBL29909406 0.84 ABCG2 (0.36) ABCG2PDE5ADHODH
SCHEMBL29909953 0.84 ABCG2 (0.37) ABCG2PDE5ADHODH
SCHEMBL29909687 0.83 ABCG2 (0.37) ABCG2PDE5ADHODH

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