SCHEMBL3962000

SCHEMBL3962000

CC(O)C(O)Oc1ccc(N)cc1N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.43
MAPT P10636 6/20 0.43
GAA P10253 5/20 0.43
KDM4E B2RXH2 5/20 0.43
CASP1 P29466 3/20 0.43
HTT P42858 3/20 0.43
POLB P06746 2/20 0.43
USP2 O75604 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TP53 P04637 1/20 0.43
CASP7 P55210 1/20 0.43
ATM Q13315 1/20 0.43
LMNA P02545 3/20 0.36
CYP2C19 P33261 1/20 0.36
ALOX5 P09917 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP3A4 P08684 1/20 0.33
THRB P10828 1/20 0.32
NR4A1 P22736 1/20 0.32

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
SCHEMBL129715 0.85 ALDH1A1 (0.46) ALDH1A1MAPTGAAKDM4ECASP1
Hydrochloric Acid SCHEMBL10397659 0.83 ALDH1A1 (0.49) ALDH1A1MAPTGAAKDM4ECASP1
Hydrochloric Acid SCHEMBL33975 0.83 ALDH1A1 (0.49) ALDH1A1MAPTGAAKDM4ECASP1
Hydrochloric Acid SCHEMBL29836005 0.83 ALDH1A1 (0.49) ALDH1A1MAPTGAAKDM4ECASP1
Hydrochloric Acid SCHEMBL1426463 0.83 ALDH1A1 (0.49) ALDH1A1MAPTGAAKDM4ECASP1
Hydrochloric Acid SCHEMBL3248993 0.83 ALDH1A1 (0.49) ALDH1A1MAPTGAAKDM4ECASP1
SCHEMBL3875281 0.80 POLB (0.49) ALDH1A1MAPTGAAKDM4ECASP1
SCHEMBL6946068 0.79 CASP1 (0.41) ALDH1A1MAPTGAAKDM4ECASP1
SCHEMBL3732045 0.79 ALDH1A1 (0.47) ALDH1A1MAPTGAAKDM4ECASP1
SCHEMBL17105948 0.77 ALDH1A1 (0.40) ALDH1A1MAPTGAAKDM4ECASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0634162-B2 Dyeing composition for keratinous fibers containing a para-aminophenol, a meta-aminophenol and a metaphenylendiamine OREAL (FR) 2009-07-22 EP claimed
US-7056352-B2 Composition for the dyeing of human hair KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2006-06-06 US claimed
EP-1380285-B1 Composition for the dyeing of human hair KPSS KAO GMBH (DE) 2005-10-19 EP claimed
US-20040006833-A1 Composition for the dyeing of human hair KPSS - KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2004-01-15 US claimed
EP-1380285-A2 Composition for the dyeing of human hair KPSS-Kao Professional Salon Services GmbH (DE) 2004-01-14 EP claimed
EP-0459900-B2 Process for dyeing of keratinic fibres with 2,4-diamino-1,3-dimethoxybenzene in an acid medium and composition using this process OREAL (FR) 2002-08-28 EP claimed
EP-0634162-B1 Dyeing composition for keratinous fibers containing a para-aminophenol, a meta-aminophenol and a metaphenylendiamine OREAL (FR) 1998-11-04 EP claimed
EP-0634162-A1 Keratinous fibers dyeing composition containing a para-aminophenol, a meta-aminophenol and a metaphenylendiamine L'OREAL (FR) 1995-01-18 EP claimed
EP-0634162-B2 Dyeing composition for keratinous fibers containing a para-aminophenol, a meta-aminophenol and a metaphenylendiamine OREAL (FR) 2009-07-22 EP disclosed
US-7056352-B2 Composition for the dyeing of human hair KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2006-06-06 US disclosed
US-7056352-B2 Composition for the dyeing of human hair KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2006-06-06 US disclosed
US-6991660-B2 Composition for the dyeing of human hair KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2006-01-31 US disclosed
EP-1380285-B1 Composition for the dyeing of human hair KPSS KAO GMBH (DE) 2005-10-19 EP disclosed
EP-1428502-A3 Composition for the dyeing of human hair KPSS-Kao Professional Salon Services GmbH (DE) 2004-08-18 EP disclosed
EP-0652742-B1 USE OF 3-SUBSTITUTED PARA-AMINOPHENOLS FOR DYEING KERATINOUS FIBRES AND NOVEL SUBSTITUTED 3-PARA-AMINOPHENOLS OREAL (FR) 1997-08-27 EP disclosed
US-5542952-A DEVELOPERS THAT FORM STABLE OXIDATION HAIR DYES L'OREAL (FR) 1996-08-06 US disclosed
US-5500021-A HAIR DYE L'OREAL (FR) 1996-03-19 US disclosed
EP-0656202-A1 Dyeing composition containing sulphurous p-phenylene-diamines, novel sulphurous p-phenylenediamines and method of preparation L'OREAL (FR) 1995-06-07 EP disclosed
EP-0634162-A1 Keratinous fibers dyeing composition containing a para-aminophenol, a meta-aminophenol and a metaphenylendiamine L'OREAL (FR) 1995-01-18 EP disclosed
WO-1994027564-A1 USE OF 3-SUBSTITUTED PARA-AMINOPHENOLS FOR DYEING KERATINOUS FIBRES AND NOVEL SUBSTITUTED 3-PARA-AMINOPHENOLS L'OREAL (FR) 1994-12-08 WO disclosed