SCHEMBL3393735

SCHEMBL3393735

Nc1cccc([N+](=O)[O-])c1CCO

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
PDE7A Q13946 1/20 0.44
TDP1 Q9NUW8 7/20 0.42
TSHR P16473 4/20 0.41
ALDH1A1 P00352 4/20 0.41
CTSD P07339 1/20 0.40
HSP90AA1 P07900 1/20 0.38
HNF4A P41235 1/20 0.38
MEN1 O00255 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
GAA P10253 1/20 0.38
POLB P06746 1/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 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
SCHEMBL7159890 0.87 GPR35 (0.54) GPR35SMN1; SMN2TDP1TSHRALDH1A1
SCHEMBL1374438 0.86 GPR35 (0.48) GPR35SMN1; SMN2PDE7ATDP1TSHR
SCHEMBL3385540 0.85 KAT2B (0.52) SMN1; SMN2TDP1TSHRALDH1A1MEN1
SCHEMBL7522876 0.84 TSHR (0.46) GPR35TDP1TSHRALDH1A1HSP90AA1
SCHEMBL7166893 0.83 TDP1 (0.46) GPR35SMN1; SMN2PDE7ATDP1TSHR
Alcohol SCHEMBL11148831 0.81 FBP1 (0.46) GPR35SMN1; SMN2PDE7ATDP1TSHR
SCHEMBL7027335 0.81 GPR35 (0.55) GPR35SMN1; SMN2TDP1TSHRALDH1A1
SCHEMBL6741088 0.80 SMN1; SMN2 (0.47) GPR35SMN1; SMN2PDE7ATDP1TSHR
SCHEMBL3599344 0.80 SMN1; SMN2 (0.47) GPR35SMN1; SMN2PDE7ATDP1TSHR
SCHEMBL4048581 0.80 TDP1 (0.47) GPR35SMN1; SMN2PDE7ATDP1TSHR

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 53 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4981486-A Washfast, lightfast; for bleached or permed hair L'OREAL (FR) 1991-01-01 US claimed
CN-117425466-A Cosmetic composition comprising at least one alkyl (poly) glycoside, N-dicarboxymethyl glutamic acid, propane-1, 3-diol, at least one fatty substance other than fatty acid, at least one dye 欧莱雅 2024-01-19 CN disclosed
CN-110035739-B Dye composition comprising 12-hydroxystearic acid, an organic amine and a dye 欧莱雅 2022-05-10 CN disclosed
CN-114340738-A Dyeing composition 莱雅公司 2022-04-12 CN disclosed
WO-2020258221-A1 DYEING COMPOSITION L'OREAL (FR) 2020-12-30 WO disclosed
CN-107595671-A The dyeing of condensation polymer comprising oxirane and expoxy propane and/or bleaching composition 莱雅公司 2018-01-19 CN disclosed
CN-107548301-A Contain composition of the menthol as soothing agent 西姆莱斯股份公司 2018-01-05 CN disclosed
CN-107501991-A Three aromatic azo methine direct dyess, colouring compositions, method and purposes comprising at least one unit from resorcinol 欧莱雅 2017-12-22 CN disclosed
CN-107252397-A Include fatty material and organic phospho acid composition, the method and apparatus using it 莱雅公司 2017-10-17 CN disclosed
CN-107049807-A For dyeing keratinous fibres and/or the double reagent of bleaching 欧莱雅 2017-08-18 CN disclosed
WO-2009077394-A1 AZOMETHINE DIRECT DYES OR REDUCED PRECURSORS OF THESE DYES OBTAINED FROM 5-(2-HYDROXYETHYLAMINO)-2-METHYLPHENOL, AND DYEING PROCESS USING THESE DYES AND PRECURSORS L'OREAL (FR) 2009-06-25 WO disclosed
WO-2008071772-A2 USE OF COLOURED OR FLUORESCENT HYBRID PARTICLES FOR TREATING KERATIN FIBRES L'OREAL (FR) 2008-06-19 WO disclosed
CN-1835730-A Coloring lightening compositions comprising at least one direct cationic dye with mixed chromophores OREAL (FR) 2006-09-20 CN disclosed
CN-1835729-A Tinctorial composition comprising at least one direct dye with mixed chromophores OREAL (FR) 2006-09-20 CN disclosed
CN-1245150-C Composition containing specific single cation monoazo dye for dyeing human cutin fiber OREAL (FR) 2006-03-15 CN disclosed
CN-1229101-C Keratin fiber dyeing composition containing specific polyamino silicone OREAL (FR) 2005-11-30 CN disclosed
CN-1201719-C Specific amino silicone containing dye composition for body's cutin fiber OREAL (FR) 2005-05-18 CN disclosed
CN-1437926-A Keratin fiber dyeing composition containing specific polyamino silicone OREAL (FR) 2003-08-27 CN disclosed
CN-1416798-A Specific amino silicone containing dye composition for body's cutin fiber OREAL (FR) 2003-05-14 CN disclosed
CN-1410047-A Composition containing specific single cation monoazo dye for dyeing human cutin fiber OREAL (FR) 2003-04-16 CN disclosed