SCHEMBL14582579

SCHEMBL14582579

O=[N+]([O-])c1ccc(/N=N/c2ccc(O)c(/N=N/c3ccc(S(=O)(=O)CCOS(=O)(=O)O)cc3S(=O)(=O)O)c2O)c(O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ CSNK2A1 P68400 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ PRMT1 Q99873 2/20 0.39
▸ APEX1 P27695 1/20 0.38
▸ MAPT P10636 4/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ POLB P06746 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38

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
SCHEMBL14582584 1.00 CYP1A2 (0.44) CYP1A2CYP3A4CYP2D6CYP2C9HPGD
SCHEMBL14582588 0.93 CYP1A2 (0.43) CYP1A2CYP3A4CYP2D6CYP2C9HPGD
SCHEMBL14582577 0.90 MEN1 (0.45) CYP1A2CYP3A4CYP2D6CYP2C9HPGD
SCHEMBL14582576 0.90 MEN1 (0.45) CYP1A2CYP3A4CYP2D6CYP2C9HPGD
SCHEMBL13892265 0.90 CYP2C19 (0.40) CYP1A2CYP3A4CYP2D6CYP2C9HPGD
SCHEMBL14613146 0.90 PRMT1 (0.46) CYP1A2CYP3A4CYP2D6CYP2C9HPGD
SCHEMBL13892224 0.89 HPGD (0.39) CYP1A2CYP3A4CYP2D6CYP2C9HPGD
SCHEMBL13892268 0.86 CYP1A2 (0.37) CYP1A2CYP3A4CYP2D6CYP2C9HPGD
SCHEMBL11673487 0.85 CYP1A2 (0.50) CYP1A2CYP3A4CYP2D6CYP2C9HPGD
SCHEMBL11673480 0.85 CYP1A2 (0.50) CYP1A2CYP3A4CYP2D6CYP2C9HPGD

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-8372161-B2 Method for the reactive coloring of leather BASF SE (DE) 2013-02-12 — — US disclosed
US-8372161-B2 Method for the reactive coloring of leather BASF SE (DE) 2013-02-12 — — US disclosed
US-20070033746-A1 Method for the reactive coloring of leather BASF AKTIENGESSELLSCHAFT (DE) 2007-02-15 — — US disclosed
US-20070033746-A1 Method for the reactive coloring of leather BASF AKTIENGESSELLSCHAFT (DE) 2007-02-15 — — US disclosed
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