SCHEMBL33692

SCHEMBL33692

Nc1ccc(N)c(OCCO)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
MAPT P10636 4/20 0.46
GAA P10253 4/20 0.46
KDM4E B2RXH2 3/20 0.46
MEN1 O00255 2/20 0.46
POLB P06746 2/20 0.46
KMT2A Q03164 2/20 0.46
HTT P42858 2/20 0.46
USP2 O75604 1/20 0.46
TP53 P04637 1/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
ATM Q13315 1/20 0.46
MAPK1 P28482 2/20 0.46
HSD17B10 Q99714 2/20 0.46
HPGD P15428 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.39
IDO1 P14902 1/20 0.38
RECQL P46063 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
SCHEMBL29393081 1.00 ALDH1A1 (0.46) ALDH1A1MAPTGAAKDM4EMEN1
Hydrochloric Acid SCHEMBL6739541 0.98 MAPT (0.49) ALDH1A1MAPTGAAKDM4EMEN1
Hydrochloric Acid SCHEMBL15301977 0.98 MAPT (0.49) ALDH1A1MAPTGAAKDM4EMEN1
Sulfuric Acid SCHEMBL6947455 0.91 ALDH1A1 (0.47) ALDH1A1MAPTGAAKDM4EMEN1
SCHEMBL2791672 0.89 APP (0.51) ALDH1A1MAPTGAAKDM4EMEN1
SCHEMBL5792387 0.89 APP (0.51) ALDH1A1MAPTGAAKDM4EMEN1
SCHEMBL11221918 0.87 ALDH1A1 (0.52) ALDH1A1MAPTGAAKDM4EMEN1
SCHEMBL6734075 0.87 ALDH1A1 (0.44) ALDH1A1MAPTGAAKDM4EMEN1
SCHEMBL23568201 0.86 ALDH1A1 (0.62) ALDH1A1MAPTKDM4EMEN1POLB
SCHEMBL2601944 0.86 GAA (0.52) ALDH1A1MAPTGAAKDM4EMEN1

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

Appears in 5312 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117460709-A Compound useful as hair dye 新加坡国立大学 2024-01-26 CN claimed
US-11555017-B2 Oxidation base derived from 1-hexyl-4,5-diaminopyrazole, composition containing same and use thereof in oxidation dyeing of keratin fibres L'OREAL (FR) 2023-01-17 US claimed
US-20200392088-A1 NOVEL OXIDATION BASE DERIVED FROM 1-HEXYL-4,5- DIAMINOPYRAZOLE, COMPOSITION CONTAINING SAME AND USE THEREOF IN OXIDATION DYEING OF KERATIN FIBRES L'OREAL (FR) 2020-12-17 US claimed
EP-3638200-A1 PROCESS FOR DYEING KERATIN MATERIALS USING AT LEAST ONE BLUE, PURPLE OR GREEN DYE AND AT LEAST ONE DISULFIDE, THIOL OR PROTECTED THIOL FLUORESCENT DYE L'Oreal (FR) 2020-04-22 EP claimed
EP-3464247-B1 NOVEL OXIDATION BASE DERIVED FROM 1-HEXYL-4,5- DIAMINOPYRAZOLE, COMPOSITION CONTAINING SAME AND USE THEREOF IN OXIDATION DYEING OF KERATIN FIBRES OREAL (FR) 2020-03-11 EP claimed
EP-3464247-A1 NOVEL OXIDATION BASE DERIVED FROM 1-HEXYL-4,5- DIAMINOPYRAZOLE, COMPOSITION CONTAINING SAME AND USE THEREOF IN OXIDATION DYEING OF KERATIN FIBRES L'Oréal (FR) 2019-04-10 EP claimed
WO-2017202884-A1 NOVEL OXIDATION BASE DERIVED FROM 1-HEXYL-4,5- DIAMINOPYRAZOLE, COMPOSITION CONTAINING SAME AND USE THEREOF IN OXIDATION DYEING OF KERATIN FIBRES L'OREAL (FR) 2017-11-30 WO claimed
EP-0850636-B2 Composition for the oxidative dyeing of keratinic fibres and dyeing process using this composition OREAL (FR) 2013-11-20 EP claimed
EP-1778176-B1 COMPOSITION FOR COLOURING KERATIN-CONTAINING FIBRES HENKEL AG & CO KGAA (DE) 2012-07-25 EP claimed
EP-1473025-B1 Dyeing composition containing 2-chloro-6-methyl-3-aminophenol and an associative polymer OREAL (FR) 2012-03-28 EP claimed
WO-1995034272-A1 OXIDATION HAIR COLOURING AGENT IN GEL FORM HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1995-12-21 WO claimed
EP-0684035-A1 Keratineous fibres oxidation dyeing composition containing a derivative of paraphenylenediamine and a 6-hydroxy 1,4-benzoxazine L'OREAL (FR) 1995-11-29 EP claimed
EP-0673641-A1 Composition for the oxidative dying of keratin fibres, comprising a paraphenylene diamine derivative and a settling cationic of amphoteric polymer, and its use L'OREAL (FR) 1995-09-27 EP claimed
EP-0665005-A1 Oxidative hair dye composition comprising a paraphenylene diamine and a metaphenylene diamine, and method of use L'OREAL (FR) 1995-08-02 EP claimed
EP-0665006-A1 Oxydative hair dying composition comprising a paraphenylene diamine and a meta-aminophenol, and method of use L'OREAL (FR) 1995-08-02 EP claimed
WO-1994028863-A1 8-AMINO-1,2,3,4-TETRAHYDROQUINOLINES AS COUPLERS IN DYES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1994-12-22 WO claimed
WO-1994026241-A1 USE OF HYDROXYNAPHTHALENES IN COLOURING AGENTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1994-11-24 WO claimed
US-4985042-A New substituted metaaminophenols, a process for their preparation, hair-dyeing compositions containing them and a hair-dyeing process L'OREAL (FR) 1991-01-15 US claimed
US-4954131-A Substituted metaaminophenols, a process for their preparation, hair-dyeing compositions containing them and a hair-dyeing process L'OREAL (FR) 1990-09-04 US claimed
US-4863480-A OXIDATION COLOR DYES THE FRENCH JOINT STOCK COMPANY "L'OREAL" (FR) 1989-09-05 US claimed