SCHEMBL210590

SCHEMBL210590

CCc1c(CCO)cc(NCCO)c([N+](=O)[O-])c1N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.43
GAA P10253 2/20 0.43
POLB P06746 2/20 0.40
HTT P42858 2/20 0.40
TDP1 Q9NUW8 3/20 0.39
ALDH1A1 P00352 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KMT2A Q03164 2/20 0.37
ATM Q13315 1/20 0.37
CDK5 Q00535 3/20 0.36
CDK5R1 Q15078 3/20 0.36
LMNA P02545 1/20 0.36
MCL1 Q07820 1/20 0.36
TSHR P16473 2/20 0.36
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35

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
SCHEMBL9023280 0.85 MAPT (0.37) MAPTGAAPOLBHTTTDP1
SCHEMBL5175161 0.83 MAPT (0.40) MAPTGAAPOLBTDP1ALDH1A1
SCHEMBL10580564 0.81 RAB9A (0.43) MAPTGAAPOLBTDP1ALDH1A1
SCHEMBL5611299 0.79 MAPT (0.41) MAPTGAAPOLBTDP1ALDH1A1
SCHEMBL10580316 0.78 MAPT (0.42) MAPTGAAPOLBTDP1ALDH1A1
SCHEMBL10577382 0.74 MAPT (0.40) MAPTGAAPOLBHTTTDP1
SCHEMBL10576372 0.74 POLB (0.38) MAPTGAAPOLBTDP1ALDH1A1
SCHEMBL10579602 0.73 POLB (0.39) MAPTGAAPOLBTDP1ALDH1A1
SCHEMBL10580519 0.73 RAB9A (0.41) MAPTGAAPOLBTDP1ALDH1A1
SCHEMBL5690966 0.73 ALDH1A1 (0.48) MAPTGAATDP1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2158942-A2 Direct hair dye composition comprising insoluble oxygenated compounds and processes L'Oreal (FR) 2010-03-03 EP claimed
EP-1757326-B1 Direct dying composition comprising insoluble oxygenated compounds and processes OREAL (FR) 2009-01-07 EP claimed
EP-1757326-A1 Direct dying composition comprising insoluble oxygenated compounds and processes L'Oréal (FR) 2007-02-28 EP claimed
EP-1430876-A1 Composition containing a direct dyestuff and a specific polymer for colouring of keratinic fibres, method for the preparation thereof and process of dyeing with such a composition L'OREAL (FR) 2004-06-23 EP claimed
EP-2488150-B1 COMPOSITION INCLUDING A GLYCERIDE AND AN ORGANOPHOSPHONIC ACID OR ONE OF THE SALTS THEREOF, DYEING OR COLOUR-LIGHTENING METHOD IMPLEMENTING SAME AND DEVICES OREAL (FR) 2018-11-21 EP disclosed
EP-2400946-B1 COMPOSITION CONTAINING A DYE AND 3-PHENYL-1-PROPANOL AND DYEING OF KERATIN FIBRES OREAL (FR) 2018-10-24 EP disclosed
EP-2301630-B1 Oxidizing composition for the treatment of keratin fibres comprising a cationic polymer, a fatty amide and an anti-oxygen agent OREAL (FR) 2018-10-24 EP disclosed
EP-1716839-B1 Emulsion comprising an aqueous solution of hydrogen peroxide and an inert phase having a solubility lower than 1% OREAL (FR) 2018-09-19 EP disclosed
EP-2198838-B1 Process and kit for lightening or direct or oxidative dyeing keratinic fibers with an aqueous composition rich in fatty compounds OREAL (FR) 2018-09-05 EP disclosed
EP-1877032-B1 INVERT EMULSION COMPRISING AN AQUEOUS SOLUTION OF HYDROGEN PEROXIDE AND AN INERT PHASE WITH WATER SOLUBILITY OF LESS THAN 1 % OREAL (FR) 2018-07-25 EP disclosed
EP-1963436-B1 SPECIFIC DYES OF NAPHTHALIMIDE TYPE, DYEING COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, METHOD OF IMPLEMENTATION AND USES OREAL (FR) 2018-04-25 EP disclosed
EP-1935455-B2 Direct dye composition comprising a cationic surfactant, a bioheteropolysaccharide, an amphoteric surfactant and a direct dye OREAL (FR) 2018-03-28 EP disclosed
EP-1428515-A1 Dyeing composition comprising a tertiary paraphenylenediamine containing a pyrrolidine, and a surfactant; method and use L'OREAL (FR) 2004-06-16 EP disclosed
EP-1428509-A1 Dyeing composition comprising a tertiary paraphenylenediamine containing a pyrrolidine, and a polyol; method and use L'OREAL (FR) 2004-06-16 EP disclosed
EP-1428508-A1 Dyeing composition comprising a tertiary paraphenylenediamine containing a pyrrolidine, and a monosaccharide or disaccharide ; method and use L'OREAL (FR) 2004-06-16 EP disclosed
EP-1386602-A1 Process for preparing a dyeing composition for dyeing keratinous fibres from pressurized vapour L'OREAL (FR) 2004-02-04 EP disclosed
EP-1380820-A1 Procedure of determining the composition of a dyeing product L'OREAL S.A. (FR) 2004-01-14 EP disclosed
EP-1312343-A2 Dyeing composition for keratinous fibres containing aminosilicone L'OREAL S.A. (FR) 2003-05-21 EP disclosed
EP-1312344-A2 Dyeing composition for keratinous fibres containing aminosilicone L'OREAL (FR) 2003-05-21 EP disclosed
EP-1297819-A2 Composition for dyeing keratinous fibres comprising a cationic azo dye L'OREAL (FR) 2003-04-02 EP disclosed