SCHEMBL23601243

SCHEMBL23601243

CN(c1cccc(-c2ccc(C3(C)CC3)nc2)c1)c1nc2nncn2c2cc(Cl)c(F)cc12

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 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
SCHEMBL29909068 0.89 ABCG2 (0.30) ABCG2
SCHEMBL24721614 0.89 ABCG2 (0.30) ABCG2
SCHEMBL29909818 0.86 MAP4K4 (0.36) ABCG2
SCHEMBL23576626 0.86 MAP4K4 (0.36) ABCG2
SCHEMBL23601023 0.85 ABCG2 (0.32) ABCG2
SCHEMBL23601244 0.85 FNTA (0.33)
SCHEMBL23578530 0.85 ABCG2 (0.33) ABCG2
SCHEMBL23577460 0.85 NT5E (0.34) ABCG2
SCHEMBL23577201 0.84 ABCG2 (0.35) ABCG2
SCHEMBL29909700 0.84 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 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