SCHEMBL22137642

SCHEMBL22137642

Cn1cc(-c2ccc3ncccc3c2)c2cc[nH]c2c1=O

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 14/20 0.60
▸ BRD9 Q9H8M2 4/20 0.53
▸ TAF1 P21675 3/20 0.53
▸ CECR2 Q9BXF3 2/20 0.53
▸ TRIM24 O15164 1/20 0.53
▸ SMARCA2 P51531 1/20 0.53
▸ SMARCA4 P51532 1/20 0.53
▸ BRPF1 P55201 1/20 0.53
▸ EP300 Q09472 1/20 0.53
▸ PBRM1 Q86U86 1/20 0.53
▸ CREBBP Q92793 1/20 0.53
▸ BAZ2B Q9UIF8 1/20 0.53
▸ BAZ2A Q9UIF9 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
SCHEMBL29455871 1.00 BRD4 (0.60) BRD4BRD9TAF1CECR2TRIM24
SCHEMBL30781745 0.83 BRD4 (0.57) BRD4BRD9TAF1CECR2TRIM24
SCHEMBL22137588 0.80 BRD4 (0.53) BRD4BRD9TAF1CECR2TRIM24
SCHEMBL15067685 0.76 BRD4 (1.00) BRD4
SCHEMBL29745823 0.76 BRD4 (1.00) BRD4
SCHEMBL31590651 0.75 BRD4 (0.66) BRD4BRD9TAF1CECR2TRIM24
SCHEMBL17748894 0.75 BRD4 (1.00) BRD4BRD9TAF1CECR2TRIM24
SCHEMBL22137701 0.74 ACVR1 (0.43) BRD4
SCHEMBL24866050 0.73 BRD4 (0.76) BRD4BRD9TAF1CECR2
SCHEMBL29670525 0.73 BRD4 (0.51) BRD4BRD9TAF1CECR2TRIM24

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-2020132004-A1 BET INHIBITORS FOR MODULATING DUX4 EXPRESSION IN FSHD SAINT LOUIS UNIVERSITY (US) 2020-06-25 — — WO disclosed
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