SCHEMBL12757233

SCHEMBL12757233

COc1ccc(N=Nc2cc(OCCCS(=O)(=O)O)c(N=Nc3cc(OCCCS(=O)(=O)O)c(N)cc3C)cc2C)c(S(=O)(=O)O)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 3/20 0.38
▸ BRD4 O60885 2/20 0.38
▸ CREBBP Q92793 1/20 0.38
▸ ENPP2 Q13822 3/20 0.37
▸ MEN1 O00255 4/20 0.33
▸ KMT2A Q03164 4/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ PAX8 Q06710 1/20 0.33
▸ KLF5 Q13887 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.32
▸ RECQL P46063 3/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ CYP3A4 P08684 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ THRB P10828 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ ALOX15 P16050 2/20 0.32
▸ MAPK1 P28482 2/20 0.32
▸ BRCA1 P38398 2/20 0.32

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
SCHEMBL12757231 0.98 TP53 (0.39) TP53BRD4CREBBPENPP2MEN1
SCHEMBL6123838 0.97 ENPP2 (0.38) TP53BRD4CREBBPENPP2MEN1
SCHEMBL12757230 0.96 TP53 (0.38) TP53BRD4CREBBPENPP2MEN1
SCHEMBL12830095 0.96 TP53 (0.38) TP53BRD4CREBBPENPP2MEN1
SCHEMBL12830093 0.94 TP53 (0.39) TP53BRD4CREBBPENPP2MEN1
SCHEMBL17787286 0.94 ENPP2 (0.38) TP53BRD4CREBBPENPP2MEN1
SCHEMBL18257420 0.94 TP53 (0.39) TP53BRD4CREBBPENPP2MEN1
SCHEMBL12757232 0.94 TP53 (0.37) TP53BRD4CREBBPENPP2MEN1
SCHEMBL12830665 0.92 TP53 (0.35) TP53BRD4CREBBPENPP2MEN1
SCHEMBL18257345 0.91 TP53 (0.38) TP53BRD4CREBBPENPP2MEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9354371-B2 Azo compounds, and dye-based polarizing films and polarizing plates comprising the same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2016-05-31 — — US disclosed
US-9354371-B2 Azo compounds, and dye-based polarizing films and polarizing plates comprising the same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2016-05-31 — — US disclosed
US-20110075076-A1 Azo Compounds, And Dye-Based Polarizing Films And Polarizing Plates Comprising The Same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-03-31 — — US disclosed
US-20110075076-A1 Azo Compounds, And Dye-Based Polarizing Films And Polarizing Plates Comprising The Same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-03-31 — — US disclosed
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