SCHEMBL31499233

SCHEMBL31499233

Cc1noc(C)c1-c1cnc2ncn(Cc3cc(F)cc(F)c3)c2c1

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.63
EP300 Q09472 1/20 0.53
CREBBP Q92793 1/20 0.53

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
SCHEMBL31499253 0.90 BRD4 (0.78) BRD4EP300CREBBP
SCHEMBL29920777 0.90 BRD4 (0.62) BRD4EP300CREBBP
SCHEMBL16347875 0.90 BRD4 (0.62) BRD4EP300CREBBP
SCHEMBL17798097 0.85 BRD4 (0.67) BRD4EP300CREBBP
SCHEMBL29920770 0.85 BRD4 (0.67) BRD4EP300CREBBP
SCHEMBL29921057 0.84 BRD4 (0.74) BRD4EP300CREBBP
SCHEMBL17798075 0.84 BRD4 (0.74) BRD4EP300CREBBP
SCHEMBL17798032 0.83 BRD4 (0.58) BRD4EP300CREBBP
SCHEMBL31499231 0.80 BRD4 (0.55) BRD4EP300CREBBP
SCHEMBL31499232 0.80 BRD4 (0.64) BRD4EP300CREBBP

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
CN-119504726-A BRD4 inhibitor and preparation method and application thereof 四川大学华西医院 2025-02-25 CN disclosed