SCHEMBL23318447

SCHEMBL23318447

COc1ccn2c(C(C)=O)cc(-c3ccccc3[S+](C)[O-])c2c1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BAZ2B Q9UIF8 16/20 0.65
▸ BAZ2A Q9UIF9 15/20 0.65
▸ BRD9 Q9H8M2 7/20 0.51
▸ SMARCA2 P51531 1/20 0.51
▸ SMARCA4 P51532 1/20 0.51
▸ TRIM33 Q9UPN9 3/20 0.47
▸ TRIM24 O15164 1/20 0.47
▸ TAF1L Q8IZX4 1/20 0.47
▸ BRD4 O60885 1/20 0.43
▸ TP53 P04637 1/20 0.42

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
SCHEMBL24510745 0.78 BAZ2B (1.00) BAZ2BBAZ2ABRD9SMARCA2SMARCA4
SCHEMBL24510741 0.72 BAZ2B (0.57) BAZ2BBAZ2ABRD9SMARCA2SMARCA4
SCHEMBL24510740 0.71 FNTA (0.60) BAZ2BBAZ2ABRD9SMARCA2SMARCA4
SCHEMBL24510742 0.70 BAZ2B (0.55) BAZ2BBAZ2ABRD9SMARCA2SMARCA4
SCHEMBL30427435 0.68 BRD9 (1.00) BAZ2BBAZ2ABRD9SMARCA2SMARCA4
SCHEMBL26302130 0.67 BAZ2B (0.69) BAZ2BBAZ2ABRD9SMARCA2SMARCA4
SCHEMBL23318444 0.67 BAZ2B (0.79) BAZ2BBAZ2ABRD9SMARCA2SMARCA4
SCHEMBL18556097 0.65 FNTA (0.54) BAZ2BBAZ2ABRD9SMARCA2SMARCA4
SCHEMBL26302067 0.65 BAZ2B (0.53) BAZ2BBAZ2ABRD9SMARCA2SMARCA4
SCHEMBL29883537 0.65 CREBBP (0.61) BAZ2BBAZ2ABRD9SMARCA2SMARCA4

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-2021087096-A1 P53 MODULATORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-05-06 — — WO disclosed
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