SCHEMBL29670309

SCHEMBL29670309

Cn1cc(-c2ccc3ccn(Cc4ccccc4)c3c2)c2cc[nH]c2c1=O

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 17/20 0.60
▸ TAF1 P21675 3/20 0.50
▸ CECR2 Q9BXF3 2/20 0.48
▸ TRIM24 O15164 1/20 0.48
▸ SMARCA2 P51531 1/20 0.48
▸ SMARCA4 P51532 1/20 0.48
▸ BRPF1 P55201 1/20 0.48
▸ EP300 Q09472 1/20 0.48
▸ PBRM1 Q86U86 1/20 0.48
▸ CREBBP Q92793 1/20 0.48
▸ BRD9 Q9H8M2 1/20 0.48
▸ BAZ2B Q9UIF8 1/20 0.48
▸ BAZ2A Q9UIF9 1/20 0.48

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
SCHEMBL29670506 0.88 BRD4 (0.52) BRD4TAF1CECR2TRIM24SMARCA2
SCHEMBL29670386 0.88 BRD4 (0.62) BRD4BRD9
SCHEMBL28622612 0.87 BRD4 (0.53) BRD4CECR2BRD9
SCHEMBL29670525 0.86 BRD4 (0.51) BRD4TAF1CECR2TRIM24SMARCA2
SCHEMBL29670464 0.84 BRD4 (0.59) BRD4TAF1CECR2TRIM24SMARCA2
SCHEMBL29670350 0.77 BRD4 (0.55) BRD4TAF1CECR2TRIM24SMARCA2
SCHEMBL28922767 0.75 BRD4 (0.56) BRD4TAF1CECR2TRIM24SMARCA2
SCHEMBL22588369 0.75 BRD4 (0.56) BRD4
SCHEMBL17748894 0.75 BRD4 (1.00) BRD4TAF1CECR2TRIM24SMARCA2
SCHEMBL22492851 0.74 BRD4 (1.00) BRD4

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-113402515-B Indole compound and preparation method and application thereof 四川大学华西医院 2022-05-27 — — CN disclosed
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