SCHEMBL31499229

SCHEMBL31499229

Cc1cc(-c2ccc3c(c2)n(C)c(=O)n3Cc2cc(F)cc(F)c2)cn(C)c1=O

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 16/20 0.69
PARG Q86W56 1/20 0.48
GRIN1 Q05586 3/20 0.47
GRIN2B Q13224 3/20 0.47
BRD9 Q9H8M2 1/20 0.44
BRD2 P25440 1/20 0.44
BRD3 Q15059 1/20 0.44
BRDT Q58F21 1/20 0.44

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
SCHEMBL31499257 0.91 BRD4 (0.61) BRD4PARGGRIN1GRIN2BBRD9
SCHEMBL31499230 0.90 BRD4 (0.72) BRD4PARGGRIN1GRIN2BBRD2
SCHEMBL31499228 0.83 BRD4 (0.61) BRD4GRIN1GRIN2BBRD9
SCHEMBL31499250 0.80 BRD4 (0.58) BRD4GRIN1GRIN2BBRD9BRD2
SCHEMBL10084499 0.70 TP53 (0.49) PARGGRIN1GRIN2B
SCHEMBL18538433 0.68 BRD4 (0.55) BRD4
SCHEMBL19925370 0.68 BRD4 (0.72) BRD4
SCHEMBL31499258 0.68 BRD4 (0.46) BRD4BRD9
SCHEMBL31499234 0.67 PARG (0.50) BRD4PARGGRIN1GRIN2B
SCHEMBL31499256 0.66 BRD4 (0.62) BRD4PARGGRIN1GRIN2B

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