SCHEMBL11819863

SCHEMBL11819863

CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N=Nc1ccc(O)c2cccc(S(=O)(=O)O)c12.[NaH]

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATIC P31939 3/20 0.59
▸ PRMT1 Q99873 1/20 0.48
▸ CYP1A2 P05177 3/20 0.46
▸ CYP2C9 P11712 2/20 0.46
▸ ALOX15 P16050 2/20 0.46
▸ CYP2C19 P33261 2/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ ALOX12 P18054 1/20 0.46
▸ CSNK2A1 P68400 1/20 0.46
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ MAPT P10636 3/20 0.43
▸ NT5E P21589 1/20 0.41
▸ MPL P40238 3/20 0.41
▸ APEX1 P27695 1/20 0.40
▸ ALDH1A1 P00352 3/20 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
SCHEMBL11775610 0.90 ATIC (0.48) ATICPRMT1CYP1A2CYP2C9ALOX15
SCHEMBL11775618 0.90 ATIC (0.48) ATICPRMT1CYP1A2CYP2C9ALOX15
SCHEMBL11819855 0.90 APEX1 (0.48) ATICPRMT1CYP1A2CYP2C9ALOX15
SCHEMBL11775599 0.90 APEX1 (0.48) ATICPRMT1CYP1A2CYP2C9ALOX15
SCHEMBL10706696 0.86 APEX1 (0.47) ATICPRMT1CYP1A2CYP2C9ALOX15
SCHEMBL9644891 0.85 ATIC (0.58) ATICPRMT1CYP1A2CYP2C9ALOX15
SCHEMBL11154811 0.83 DDX3X (0.46) ATICPRMT1CYP1A2CYP2C9ALOX15
SCHEMBL10883468 0.81 DDX3X (0.47) ATICPRMT1CYP1A2CYP2C9ALOX15
SCHEMBL10883796 0.81 DDX3X (0.47) ATICPRMT1CYP1A2CYP2C9ALOX15
SCHEMBL10883463 0.81 DDX3X (0.47) ATICPRMT1CYP1A2CYP2C9ALOX15

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-3942987-A Photographic materials with ballasted, alkali cleavable azo dyes EASTMAN KODAK COMPANY 1976-03-09 — — US disclosed
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