SCHEMBL15534710

SCHEMBL15534710

CCN(O)c1ccc(S(=O)(=O)O)cc1[N+](=O)[O-]

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
KDM4E B2RXH2 1/20 0.49
HTT P42858 1/20 0.49
HPGD P15428 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
VCAM1 P19320 7/20 0.46
HCAR3 P49019 3/20 0.46
NSD2 O96028 1/20 0.44
GAA P10253 1/20 0.44
PLCG1 P19174 1/20 0.44
DNMT1 P26358 1/20 0.44
CASP6 P55212 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ALDH3A1 P30838 1/20 0.43
KMT2A Q03164 1/20 0.42
LMNA P02545 1/20 0.41
CYP2C9 P11712 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
SCHEMBL10060156 0.81 ALDH1A1 (0.71) ALDH1A1KDM4EHTTHPGDTDP1
SCHEMBL182012 0.80 HCAR3 (0.49) ALDH1A1KDM4EHTTTDP1HCAR3
SCHEMBL7041286 0.80 TSHR (0.53) ALDH1A1KDM4EHTTTDP1HCAR3
SCHEMBL1886680 0.79 ALDH1A1 (0.51) ALDH1A1KDM4EHTTTDP1HCAR3
SCHEMBL11271182 0.77 POLB (0.52) ALDH1A1KDM4EHCAR3ALDH3A1KMT2A
SCHEMBL10796104 0.76 ALDH1A1 (0.54) ALDH1A1HPGDTDP1VCAM1NSD2
SCHEMBL1455684 0.75 MAPK1 (0.49) ALDH1A1KDM4EHPGDTDP1HCAR3
SCHEMBL3655437 0.74 ALDH1A1 (0.46) ALDH1A1HTTTDP1HCAR3L3MBTL1
SCHEMBL3201792 0.74 ALDH1A1 (0.58) ALDH1A1KDM4EHTTHPGDTDP1
SCHEMBL392626 0.73 HPGD (0.62) ALDH1A1HPGDTDP1VCAM1NSD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022258494-A1 HAIR DYEING PROCESS COMPRISING THE APPLICATION OF A (POLY)CARBODIIMIDE COMPOUND, OF A POLYMER BEARING A CARBOXYLIC GROUP AND OF A NON-SILICONE FATTY SUBSTANCE L'OREAL (FR) 2022-12-15 WO disclosed
EP-3554463-A1 COMPOSITION COMPRISING AT LEAST TWO ANIONIC SURFACTANTS, A NONIONIC SURFACTANT, AN AMPHOTERIC SURFACTANT, AND AT LEAST ONE DIRECT DYE L'Oréal (FR) 2019-10-23 EP disclosed
WO-2019002494-A1 USE OF A WASHING COMPOSITION COMPRISING SURFACTANTS AND CATIONIC AND/OR AMPHOTERIC POLYMERS IN COMBINATION WITH A COMPOSITION COMPRISING ANIONIC BENEFICIAL AGENTS L'OREAL (FR) 2019-01-03 WO disclosed
WO-2018109154-A1 COMPOSITION COMPRISING AT LEAST TWO ANIONIC SURFACTANTS, A NONIONIC SURFACTANT, AN AMPHOTERIC SURFACTANT, AND AT LEAST ONE DIRECT DYE L'OREAL (FR) 2018-06-21 WO disclosed
CN-104379117-B The method for being used for keratin fiber and being dyed including dyes/pigments, light-sensitive compound and light source 莱雅公司 2018-03-06 CN disclosed
WO-2015097310-A1 LIGHTENING DYEING PROCESS USING A SUBSTRATE BEARING AT LEAST ONE OXIDIZING AGENT AND AN AQUEOUS COMPOSITION COMPRISING ONE OR MORE DIRECT DYES L'OREAL (FR) 2015-07-02 WO disclosed
EP-2854749-A2 ANIONIC DYE OR BRIGHTENER BEARING AN AMMONIUM OR PHOSPHONIUM COUNTERION, DYE COMPOSITION COMPRISING THEM AND PROCESS FOR DYEING KERATIN FIBRES USING THESE DYES L'Oréal (FR) 2015-04-08 EP disclosed
CN-104379117-A Process for dyeing keratin fibres comprising a dye/pigment, a photoactive compound and a light source OREAL 2015-02-25 CN disclosed
WO-2013175002-A2 ANIONIC DYE OR BRIGHTENER BEARING AN AMMONIUM OR PHOSPHONIUM COUNTERION, DYE COMPOSITION COMPRISING THEM AND PROCESS FOR DYEING KERATIN FIBRES USING THESE DYES L'OREAL (FR) 2013-11-28 WO disclosed