SCHEMBL11339474

SCHEMBL11339474

O=C(O)c1ccc(-c2c3nc(c(-c4ccc(C(=O)O)cc4)c4ccc([nH]4)c(-c4ccc(C(=O)O)cc4)c4nc(cc5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 4/20 0.75
▸ CYCS P99999 4/20 0.73
▸ STAT3 P40763 1/20 0.62
▸ STAT1 P42224 1/20 0.62
▸ ENPP2 Q13822 1/20 0.47
▸ ABCG2 Q9UNQ0 1/20 0.44
▸ TERT O14746 3/20 0.41
▸ MMP2 P08253 1/20 0.39
▸ MMP9 P14780 1/20 0.39
▸ MMP8 P22894 1/20 0.39
▸ MMP13 P45452 1/20 0.39
▸ GRIK1 P39086 1/20 0.39
▸ GRIK2 Q13002 1/20 0.39
▸ GRIK3 Q13003 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ KMT2A Q03164 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
SCHEMBL22332272 0.97 TOP1 (0.70) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL140681 0.95 TOP1 (0.67) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL17894094 0.95 TOP1 (0.75) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL11334086 0.94 TOP1 (0.65) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL28919688 0.94 TOP1 (0.65) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL22332236 0.89 TOP1 (0.60) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL28071729 0.89 TOP1 (0.63) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL26285347 0.88 TOP1 (0.57) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL14246834 0.87 CYCS (0.62) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL29664855 0.87 CYCS (0.62) TOP1CYCSSTAT3STAT1ENPP2

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-4256597-A DETERGENT AND PHOTOINITIATOR COMPRISING A PORPHINE OR MONO, DI, OR TRIAZO PORPHINE, OR PHTHALOCYANINE COMPOUND; WATER SOLUBILITY; STAIN REMOVAL THE PROCTER & GAMBLE COMPANY (US) 1981-03-17 — — US disclosed
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