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SCHEMBL14601903

SCHEMBL14601903

Cc1c2nc(cc3ccc([nH]3)c(-c3c4nc(cc5ccc([nH]5)c(-c5ccc(-c6c7nc(cc8ccc([nH]8)c(-c8c9nc(cc%10ccc([nH]%10)c(C)c%10nc(cc%11ccc8[nH]%11)C=C%10)C=C9)c8nc(cc9ccc6[nH]9)C=C8)C=C7)cc5)c5nc(cc6ccc3[nH]6)C=C5)C=C4)c3nc(cc4ccc1[nH]4)C=C3)C=C2

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.68
▸ STAT1 P42224 1/20 0.68
▸ TERT O14746 5/20 0.41
▸ TOP1 P11387 4/20 0.40
▸ CYCS P99999 4/20 0.40
▸ ABCG2 Q9UNQ0 1/20 0.40
▸ ENPP2 Q13822 1/20 0.39

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
SCHEMBL15631531 0.93 STAT3 (0.80) STAT3STAT1TERTTOP1CYCS
SCHEMBL8689820 0.89 STAT3 (0.68) STAT3STAT1TERTTOP1CYCS
SCHEMBL13547836 0.88 STAT3 (0.56) STAT3STAT1
SCHEMBL30574153 0.87 STAT3 (0.66) STAT3STAT1TERTTOP1CYCS
SCHEMBL30205816 0.86 STAT3 (0.64) STAT3STAT1TERTTOP1CYCS
SCHEMBL30519987 0.86 STAT3 (0.64) STAT3STAT1TERTTOP1CYCS
SCHEMBL5319095 0.86 STAT3 (0.64) STAT3STAT1TERTTOP1CYCS
SCHEMBL3286041 0.86 STAT3 (0.64) STAT3STAT1TERTTOP1CYCS
SCHEMBL2563180 0.85 STAT3 (0.91) STAT3STAT1TERTTOP1CYCS
SCHEMBL479428 0.85 STAT3 (0.54) STAT3STAT1

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
US-7196364-B2 Molecular device, molecule array, rectifier device, rectifying method, sensor device, switching device, circuit device, logical circuit device, operational device and information processing device SONY CORPORATION (JP) 2007-03-27 — — US disclosed
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