SCHEMBL13937838

SCHEMBL13937838

Nc1ccc(/N=N/c2c(SOOO)cc3c(S(=O)(=O)O)cc(/N=N/c4ccc([N+](=O)[O-])cc4SOOO)c(O)c3c2O)c(S(=O)(=O)O)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 3/20 0.40
▸ HPGD P15428 3/20 0.40
▸ ALOX15 P16050 3/20 0.40
▸ HSD17B10 Q99714 3/20 0.40
▸ CYP1A2 P05177 2/20 0.40
▸ CYP2D6 P10635 2/20 0.40
▸ CYP2C9 P11712 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ CSNK2A1 P68400 1/20 0.40
▸ ENPP2 Q13822 4/20 0.39
▸ PRMT1 Q99873 1/20 0.38
▸ APEX1 P27695 3/20 0.37
▸ NT5E P21589 2/20 0.37
▸ PTPN11 Q06124 1/20 0.35
▸ PHLPP2 Q6ZVD8 2/20 0.35
▸ MEN1 O00255 3/20 0.33
▸ MAPT P10636 3/20 0.33
▸ KMT2A Q03164 3/20 0.33

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
SCHEMBL13937840 0.91 PTPN11 (0.40) CYP3A4HPGDALOX15HSD17B10CYP1A2
SCHEMBL13937837 0.87 CYP3A4 (0.37) CYP3A4HPGDALOX15HSD17B10CYP1A2
SCHEMBL13386581 0.85 ENPP2 (0.46) CYP3A4HPGDALOX15HSD17B10CYP1A2
SCHEMBL14374652 0.84 ENPP2 (0.38) CYP3A4HPGDALOX15HSD17B10CYP1A2
SCHEMBL14268605 0.84 ENPP2 (0.38) CYP3A4HPGDALOX15HSD17B10CYP1A2
SCHEMBL14374727 0.84 ENPP2 (0.42) CYP3A4HPGDALOX15HSD17B10CYP1A2
SCHEMBL13937839 0.82 ENPP2 (0.46) CYP3A4HPGDALOX15HSD17B10CYP1A2
SCHEMBL14374896 0.82 ENPP2 (0.36) CYP3A4HPGDALOX15HSD17B10CYP1A2
SCHEMBL13937907 0.81 ENPP2 (0.50) CYP3A4HPGDALOX15HSD17B10CYP1A2
SCHEMBL14268631 0.81 ENPP2 (0.37) CYP3A4HPGDALOX15HSD17B10CYP1A2

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-7481522-B2 Compositions and inks containing disazo dyes FUJIFILM IMAGING COLORANTS LIMITED (GB) 2009-01-27 — — US disclosed
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