SCHEMBL28458931

SCHEMBL28458931

Cn1cc(-c2cn(Cc3ccc(C(F)(F)F)cc3)cn2)c2cc[nH]c2c1=O

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 18/20 0.63
▸ BRD9 Q9H8M2 1/20 0.47

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
SCHEMBL28472107 0.80 BRD4 (0.47) BRD4BRD9
SCHEMBL22492883 0.77 BRD4 (1.00) BRD4
SCHEMBL31590058 0.77 BRD9 (0.74) BRD4BRD9
SCHEMBL29976955 0.76 BRD4 (1.00) BRD4
SCHEMBL22492854 0.76 BRD4 (1.00) BRD4
SCHEMBL22516529 0.76 BRD4 (0.79) BRD4
SCHEMBL30302433 0.75 BRD4 (0.71) BRD4
SCHEMBL22492898 0.75 BRD4 (1.00) BRD4
SCHEMBL29670386 0.74 BRD4 (0.62) BRD4BRD9
SCHEMBL22492855 0.72 BRD4 (0.77) BRD4

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-111712496-B Compounds and compositions as bromodomain protein inhibitors 贝达药业股份有限公司 2023-05-02 — — CN disclosed
CN-111712496-A Compounds and compositions as bromodomain protein inhibitors 贝达药业股份有限公司 2020-09-25 — — CN disclosed
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