SCHEMBL31499258

SCHEMBL31499258

Cc1cc(-c2ccc3c(c2)n(C)c(=O)n3C(=O)c2ccc(O)c(F)c2)cn(C)c1=O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 17/20 0.46
BRD9 Q9H8M2 2/20 0.46
HSD17B1 P14061 2/20 0.36
HSD17B2 P37059 2/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL31499227 0.77 ERN1 (0.44) BRD4
SCHEMBL31499229 0.68 BRD4 (0.69) BRD4BRD9
SCHEMBL19869661 0.66 BRD4 (0.75) BRD4BRD9
SCHEMBL31499230 0.65 BRD4 (0.72) BRD4
SCHEMBL31499228 0.65 BRD4 (0.61) BRD4BRD9
SCHEMBL24556415 0.63 BRD4 (0.69) BRD4BRD9KDM4E
SCHEMBL19869660 0.63 BRD4 (0.69) BRD4BRD9
SCHEMBL24556560 0.63 BRD4 (0.54) BRD4BRD9
SCHEMBL31499250 0.63 BRD4 (0.58) BRD4BRD9
SCHEMBL19869693 0.63 BRD4 (0.64) BRD4BRD9

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