SCHEMBL8431348

SCHEMBL8431348

COc1ccc(-c2c3nc(c(-c4ccc(OC)cc4)c4ccc([nH]4)c(-c4ccc(OC)cc4)c4nc(cc5ccc2[nH]5)C=C4)C=C3)cc1.COc1ccc([Pd])cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.54
▸ STAT1 P42224 1/20 0.54
▸ ABCG2 Q9UNQ0 1/20 0.41
▸ TERT O14746 4/20 0.40
▸ TOP1 P11387 4/20 0.40
▸ CYCS P99999 4/20 0.39
▸ ENPP2 Q13822 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ CASP3 P42574 1/20 0.35
▸ SENP8 Q96LD8 1/20 0.35
▸ SENP7 Q9BQF6 1/20 0.35
▸ SENP6 Q9GZR1 1/20 0.35
▸ AURKA O14965 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL4266558 0.92 STAT3 (0.63) STAT3STAT1ABCG2TERTTOP1
SCHEMBL9590030 0.89 STAT3 (0.60) STAT3STAT1ABCG2TERTTOP1
SCHEMBL3838362 0.89 STAT3 (0.54) STAT3STAT1ABCG2TERTTOP1
SCHEMBL8996959 0.88 STAT3 (0.59) STAT3STAT1ABCG2TERTTOP1
SCHEMBL7257328 0.86 STAT3 (0.56) STAT3STAT1ABCG2TERTTOP1
SCHEMBL5011955 0.85 STAT3 (0.55) STAT3STAT1ABCG2TERTTOP1
SCHEMBL6804332 0.82 STAT3 (0.59) STAT3STAT1ABCG2TERTTOP1
SCHEMBL29414382 0.81 TERT (0.57) ABCG2TERTTOP1CYCSENPP2
SCHEMBL949511 0.81 TERT (0.57) ABCG2TERTTOP1CYCSENPP2
SCHEMBL30519987 0.80 STAT3 (0.64) STAT3STAT1ABCG2TERTTOP1

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
EP-0641454-B1 OPTICAL FILTER BARR & STROUD LTD (GB) 1999-11-17 — — EP claimed
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