SCHEMBL18257345

SCHEMBL18257345

Cc1cc(N)c(OCCCS(=O)(=O)O)cc1N=Nc1ccc(OCCCS(=O)(=O)O)cc1S(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 2/20 0.38
▸ BRD4 O60885 2/20 0.38
▸ CREBBP Q92793 1/20 0.38
▸ PDIA6 Q15084 1/20 0.38
▸ ENPP2 Q13822 1/20 0.36
▸ PLA2G2A P14555 2/20 0.35
▸ ALDH1A1 P00352 5/20 0.34
▸ MEN1 O00255 4/20 0.34
▸ KMT2A Q03164 4/20 0.34
▸ KDM4E B2RXH2 4/20 0.34
▸ SUMO2 P61956 3/20 0.34
▸ SUMO1 P63165 3/20 0.34
▸ SENP7 Q9BQF6 3/20 0.34
▸ SENP2 Q9HC62 3/20 0.34
▸ MAPT P10636 3/20 0.34
▸ CYP3A4 P08684 2/20 0.34
▸ ALOX15 P16050 2/20 0.34
▸ BRCA1 P38398 2/20 0.34
▸ RECQL P46063 2/20 0.34
▸ BLM P54132 2/20 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
SCHEMBL18257420 0.97 TP53 (0.39) TP53BRD4CREBBPPDIA6ENPP2
SCHEMBL6123838 0.94 ENPP2 (0.38) TP53BRD4CREBBPPDIA6ENPP2
SCHEMBL12757231 0.93 TP53 (0.39) TP53BRD4CREBBPENPP2ALDH1A1
SCHEMBL18257309 0.92 TP53 (0.42) TP53BRD4CREBBPPDIA6PLA2G2A
SCHEMBL12757233 0.91 TP53 (0.38) TP53BRD4CREBBPENPP2ALDH1A1
SCHEMBL17787286 0.91 ENPP2 (0.38) TP53BRD4CREBBPPDIA6ENPP2
SCHEMBL6126049 0.90 P2RX5 (0.41) TP53BRD4CREBBPENPP2ALDH1A1
SCHEMBL18257343 0.89 P2RX5 (0.43) TP53BRD4CREBBPENPP2ALDH1A1
SCHEMBL6123832 0.87 SENP2 (0.41) TP53BRD4CREBBPENPP2PLA2G2A
SCHEMBL12757230 0.87 TP53 (0.38) TP53BRD4CREBBPENPP2ALDH1A1

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-2016186194-A1 AZO COMPOUNDS, DYE-BASED POLARIZING FILM CONTAINING SAME, AND POLARIZING PLATE 日本化薬株式会社 2016-11-24 — — WO disclosed
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