SCHEMBL29670350

SCHEMBL29670350

CCC(C)n1ccc2ccc(-c3cn(C)c(=O)c4[nH]ccc34)cc21

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 13/20 0.55
▸ EZH2 Q15910 7/20 0.55
▸ BRD2 P25440 1/20 0.55
▸ BRD3 Q15059 1/20 0.55
▸ BRDT Q58F21 1/20 0.55
▸ EZH1 Q92800 1/20 0.55
▸ BRD9 Q9H8M2 3/20 0.47
▸ TAF1 P21675 2/20 0.46
▸ CECR2 Q9BXF3 2/20 0.46
▸ TRIM24 O15164 1/20 0.46
▸ SMARCA2 P51531 1/20 0.46
▸ SMARCA4 P51532 1/20 0.46
▸ BRPF1 P55201 1/20 0.46
▸ EP300 Q09472 1/20 0.46
▸ PBRM1 Q86U86 1/20 0.46
▸ CREBBP Q92793 1/20 0.46
▸ BAZ2B Q9UIF8 1/20 0.46
▸ BAZ2A Q9UIF9 1/20 0.46

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
SCHEMBL28922767 0.92 BRD4 (0.56) BRD4EZH2BRD2BRD3BRDT
SCHEMBL29670309 0.77 BRD4 (0.60) BRD4BRD9TAF1CECR2TRIM24
SCHEMBL28635044 0.76 BRD4 (0.56) BRD4EZH2BRD2BRD3BRDT
SCHEMBL29670506 0.75 BRD4 (0.52) BRD4BRD9TAF1CECR2TRIM24
SCHEMBL28622612 0.74 BRD4 (0.53) BRD4BRD9CECR2
SCHEMBL29670525 0.73 BRD4 (0.51) BRD4BRD2BRD3BRD9TAF1
SCHEMBL29670386 0.73 BRD4 (0.62) BRD4BRD9
SCHEMBL26331774 0.71 BRD4 (0.70) BRD4BRD9TAF1CECR2
SCHEMBL31590651 0.71 BRD4 (0.66) BRD4BRD9TAF1CECR2TRIM24
SCHEMBL24866050 0.70 BRD4 (0.76) BRD4BRD9TAF1CECR2

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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