SCHEMBL4806160

SCHEMBL4806160

Cc1cc(S(=O)(=O)O)c([N+](=O)[O-])cc1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NSD2 O96028 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ PLCG1 P19174 1/20 0.49
▸ DNMT1 P26358 1/20 0.49
▸ CASP6 P55212 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ ALDH1A1 P00352 5/20 0.43
▸ CYP3A4 P08684 4/20 0.43
▸ TDP1 Q9NUW8 3/20 0.43
▸ TSHR P16473 3/20 0.42
▸ RECQL P46063 1/20 0.42
▸ CA9 Q16790 4/20 0.41
▸ CA12 O43570 3/20 0.41
▸ CA1 P00915 3/20 0.41
▸ CA2 P00918 3/20 0.41
▸ GPR35 Q9HC97 3/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ POLB P06746 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ PKM P14618 1/20 0.40

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
SCHEMBL11595993 0.87 GAA (0.49) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL10350683 0.84 NSD2 (0.53) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL11520955 0.84 TSHR (0.42) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL11521960 0.84 TSHR (0.42) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL11521070 0.83 TSHR (0.41) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL8423336 0.81 GAA (0.54) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL10351830 0.81 NSD2 (0.53) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL1708533 0.80 GAA (0.49) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL2360457 0.80 GAA (0.49) NSD2GAAPLCG1DNMT1CASP6
SCHEMBL11973321 0.80 VCAM1 (0.41) NSD2GAAPLCG1DNMT1CASP6

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-20080075686-A1 Deodorizer and method for using the same TOTO LTD. (JP) 2008-03-27 — — US disclosed
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