SCHEMBL461005

SCHEMBL461005

Nc1cccc(OCCO)c1N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP2C9 P11712 1/20 0.44
ALDH1A1 P00352 3/20 0.42
RECQL P46063 1/20 0.42
IDO1 P14902 1/20 0.42
ALOX5AP P20292 2/20 0.38
FEN1 P39748 2/20 0.38
TP53 P04637 2/20 0.38
MAPK1 P28482 1/20 0.38
RAB9A P51151 1/20 0.38
KDM4E B2RXH2 1/20 0.38
LOX P28300 1/20 0.37
AOC3 Q16853 1/20 0.37
HTR1B P28222 3/20 0.37
HTR1D P28221 1/20 0.37
LMNA P02545 2/20 0.36
JAK2 O60674 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL10629740 0.92 ALDH1A1 (0.48) CYP1A2CYP2C19CYP2C9ALDH1A1RECQL
SCHEMBL6239790 0.90 CYP1A2 (0.47) CYP1A2CYP2C19CYP2C9ALDH1A1TP53
SCHEMBL29903407 0.83 CYP1A2 (0.62) CYP1A2CYP2C19CYP2C9ALDH1A1RECQL
SCHEMBL2411822 0.83 CYP1A2 (0.62) CYP1A2CYP2C19CYP2C9ALDH1A1RECQL
SCHEMBL10631959 0.82 TSHR (0.47) ALDH1A1LMNATSHRDHPS
SCHEMBL307639 0.82 CYP1A2 (0.43) CYP1A2CYP2C19CYP2C9ALDH1A1RECQL
Hydrochloric Acid SCHEMBL25376100 0.82 CYP1A2 (0.60) CYP1A2CYP2C19CYP2C9ALDH1A1RECQL
SCHEMBL27952237 0.82 KDM4E (0.59) CYP1A2CYP2C19CYP2C9ALDH1A1TP53
SCHEMBL10635778 0.81 TSHR (0.46) CYP1A2CYP2C19CYP2C9ALDH1A1RECQL
SCHEMBL10633040 0.81 ALDH1A1 (0.44) CYP1A2CYP2C19CYP2C9ALDH1A1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015139883-A1 COMPOSITION FOR ALTERING THE COLOR OF KERATIN FIBERS L'OREAL (FR) 2015-09-24 WO disclosed
WO-2013069165-A1 COSMETIC COMPOSITION FOR KERATIN FIBERS L'OREAL (FR) 2013-05-16 WO disclosed
WO-2013069168-A1 COSMETIC COMPOSITION FOR KERATIN FIBERS L'OREAL (FR) 2013-05-16 WO disclosed
WO-2013069166-A1 COSMETIC COMPOSITION FOR KERATIN FIBERS L'OREAL (FR) 2013-05-16 WO disclosed
EP-2515831-A2 INVERSE EMULSION FOR TREATING THE HAIR COMPRISING A PARTICULAR FATTY SUBSTANCE AND AN ALKALINE AGENT L'Oréal (FR) 2012-10-31 EP disclosed
EP-2473235-A1 COMPOSITION COMPRISING AN ACID DYE OF INDIGOID TYPE AND DYEING METHOD L'Oréal (FR) 2012-07-11 EP disclosed
WO-2012032673-A1 COSMETIC COMPOSITION FOR KERATIN FIBERS L'OREAL (FR) 2012-03-15 WO disclosed
WO-2011076647-A2 INVERSE EMULSION FOR TREATING THE HAIR COMPRISING A PARTICULAR FATTY SUBSTANCE AND AN ALKALINE AGENT L'OREAL (FR) 2011-06-30 WO disclosed
WO-2011026918-A1 COMPOSITION COMPRISING AN ACID DYE OF INDIGOID TYPE AND DYEING METHOD L'OREAL (FR) 2011-03-10 WO disclosed
EP-2234584-A2 COMPOSITION COMPRISING AN ALKANOLAMINE, A BASIC AMINO ACID AND A SUITABLY SELECTED ADDITIONAL ALKALINE AGENT L'Oréal (FR) 2010-10-06 EP disclosed
WO-2001068042-A1 METHOD FOR DYEING DRY HAIR NOVOZYMES A/S (DK) 2001-09-20 WO disclosed
WO-2001000144-A2 HAIR COMPOSITION COMPRISING AN OXIDASE AND CYCLODEXTRIN LION CORPORATION (JP) 2001-01-04 WO disclosed
WO-2000078273-A2 PROCESS FOR PRODUCING A HAIRDYE COMPOSITION LION CORPORATION (JP) 2000-12-28 WO disclosed
WO-2000078274-A2 HAIRDYE COMPOSITION COMPRISING INDOLINE AND/OR AN INDOLINE COMPOUND AND LACCASE LION CORPORATION (JP) 2000-12-28 WO disclosed
WO-2000059459-A1 HAIRDYE COMPOSITION OF SINGLE PREPARATION TYPE CONTAINING AN OXIDASE LION CORPORATION (JP) 2000-10-12 WO disclosed
WO-2000032158-A1 METHOD FOR TREATING HAIR NOVOZYMES A/S (DK) 2000-06-08 WO disclosed
EP-0331144-B1 3-SUBSTITUTED PARA-AMINO PHENOLS, PROCESS FOR THEIR PREPARATION, THEIR USE IN DYEING KERATENIC FIBRES AND INTERMEDIATES USED IN THE PREPARATION PROCESS L'OREAL (FR) 1993-06-09 EP disclosed
EP-0359618-B1 2-SUBSTITUTED PARA-AMINOPHENOLS AND THEIR USE IN THE COLORATION OF KERATINIC FIBRES L'OREAL (FR) 1993-03-17 EP disclosed
EP-0359618-A1 2-Substituted para-aminophenols and their use in the coloration of keratinic fibres L'OREAL (FR) 1990-03-21 EP disclosed
EP-0331144-A2 3-Substituted para-amino phenols, process for their preparation, their use in dyeing keratenic fibres and intermediates used in the preparation process L'OREAL (FR) 1989-09-06 EP disclosed