SCHEMBL6693557

SCHEMBL6693557

O=C(O)c1ccc(-c2c3nc(c(-c4ccccc4)c4ccc([nH]4)c(-c4ccccc4)c4nc(c(-c5ccccc5)c5ccc2[nH]5)C=C4)C=C3)cc1.[Zn]

nearest known ligand 0.88

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 4/20 0.88
▸ CYCS P99999 4/20 0.86
▸ ENPP2 Q13822 1/20 0.54
▸ ABCG2 Q9UNQ0 1/20 0.50
▸ STAT3 P40763 1/20 0.49
▸ STAT1 P42224 1/20 0.49
▸ KDM4E B2RXH2 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ GLA P06280 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ TERT O14746 1/20 0.47

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
SCHEMBL25394852 0.98 TOP1 (0.91) TOP1CYCSENPP2ABCG2STAT3
SCHEMBL29556585 0.98 TOP1 (0.91) TOP1CYCSENPP2ABCG2STAT3
SCHEMBL16418477 0.98 TOP1 (0.91) TOP1CYCSENPP2ABCG2STAT3
SCHEMBL25395869 0.98 TOP1 (0.91) TOP1CYCSENPP2ABCG2STAT3
SCHEMBL483511 0.98 TOP1 (0.91) TOP1CYCSENPP2ABCG2STAT3
SCHEMBL19640818 0.97 CYCS (0.91) TOP1CYCSENPP2ABCG2STAT3
SCHEMBL29520928 0.97 TOP1 (0.88) TOP1CYCSENPP2ABCG2STAT3
SCHEMBL6686149 0.97 TOP1 (0.88) TOP1CYCSENPP2ABCG2STAT3
SCHEMBL1497141 0.95 TOP1 (0.97) TOP1CYCSENPP2ABCG2KDM4E
SCHEMBL29646534 0.95 TOP1 (0.97) TOP1CYCSENPP2ABCG2KDM4E

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
WO-2004092185-A1 LUMINESCENT LANTHANIDE (III) -CHELATED DENDRITIC COMPLEXES HAVING LIGHT-HARVESTING EFFECT AND THEIR SYNTHETIC METHODS KIM HWAN-KYU (KR) 2004-10-28 — — WO disclosed
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