SCHEMBL19456159

SCHEMBL19456159

CNC(=O)c1cc(C)cc2c1OC(CF)C2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 17/20 0.39
▸ TRIM24 O15164 1/20 0.35
▸ BRD1 O95696 1/20 0.35
▸ CCL2 P13500 1/20 0.35
▸ DRD2 P14416 1/20 0.35
▸ TAF1 P21675 1/20 0.35
▸ DRD4 P21917 1/20 0.35
▸ BRD2 P25440 1/20 0.35
▸ DRD3 P35462 1/20 0.35
▸ SMARCA2 P51531 1/20 0.35
▸ SMARCA4 P51532 1/20 0.35
▸ BRPF1 P55201 1/20 0.35
▸ EP300 Q09472 1/20 0.35
▸ BPTF Q12830 1/20 0.35
▸ BRD3 Q15059 1/20 0.35
▸ BRDT Q58F21 1/20 0.35
▸ ATAD2 Q6PL18 1/20 0.35
▸ PBRM1 Q86U86 1/20 0.35
▸ TAF1L Q8IZX4 1/20 0.35
▸ CREBBP Q92793 1/20 0.35

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
SCHEMBL19456132 0.88 RXFP1 (0.33) BRD4PARP1
SCHEMBL21649948 0.87 FUCA1 (0.37) BRD4PARP1
SCHEMBL19456190 0.87 BRD4 (0.49) BRD4TRIM24BRD1CCL2DRD2
SCHEMBL21649777 0.86 TAS1R3 (0.40) BRD4
SCHEMBL19456188 0.86 PARP1 (0.32) PARP1
SCHEMBL19456276 0.86 BRD4 (0.38) BRD4TRIM24BRD1CCL2DRD2
SCHEMBL19456376 0.85 BRD4 (0.45) BRD4TRIM24BRD1CCL2DRD2
SCHEMBL19456404 0.84 PARP1 (0.34) PARP1
SCHEMBL21649942 0.84 BRD4 (0.52) BRD4TRIM24BRD1CCL2DRD2
SCHEMBL19456300 0.84 BRD4 (0.37) BRD4TRIM24BRD1CCL2DRD2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3440075-B1 BENZO[B]FURANS AS BROMODOMAIN INHIBITORS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2020-01-29 — — EP disclosed
WO-2017174620-A1 BENZO[B]FURANS AS BROMODOMAIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-10-12 — — WO disclosed
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