SCHEMBL854840

SCHEMBL854840

COc1c(O)ccc(N)c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
TDP1 Q9NUW8 3/20 0.44
GAA P10253 2/20 0.44
THRB P10828 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
RECQL P46063 1/20 0.44
BLM P54132 1/20 0.44
KMT2A Q03164 1/20 0.44
MCL1 Q07820 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ESR1 P03372 3/20 0.40
ESR2 Q92731 3/20 0.40
HSD17B10 Q99714 2/20 0.40
ALOX15 P16050 1/20 0.40
CA1 P00915 2/20 0.38
CA12 O43570 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 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
SCHEMBL27360380 0.82 ALDH1A1 (0.47) ALDH1A1TDP1GAATHRBKDM4E
SCHEMBL68271 0.81 TDP1 (0.44) ALDH1A1TDP1KDM4EMAPTSMN1; SMN2
SCHEMBL1979957 0.81 CYP3A4 (0.43) ALDH1A1TDP1GAATHRBKDM4E
SCHEMBL8940830 0.78 ESR1 (0.42) ALDH1A1TDP1GAAKDM4EMEN1
SCHEMBL27492936 0.78 SCN5A (0.38) ALDH1A1TDP1GAATHRBKDM4E
SCHEMBL10460608 0.77 MAOA (0.43) TDP1ESR1ESR2CA1CA12
SCHEMBL8293654 0.77 TUBB1 (0.41) ALDH1A1TDP1GAAKDM4ESMN1; SMN2
SCHEMBL29421917 0.76 MAOB (0.45) ALDH1A1TDP1KDM4EMAPTESR1
SCHEMBL5141870 0.76 MAOB (0.45) ALDH1A1TDP1KDM4EMAPTESR1
SCHEMBL29403778 0.75 TDP1 (0.52) ALDH1A1TDP1GAATHRBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-1473025-B1 Dyeing composition containing 2-chloro-6-methyl-3-aminophenol and an associative polymer OREAL (FR) 2012-03-28 EP claimed
US-7060112-B2 Composition for the oxidation dyeing of keratinous fibers containing a laccase and dyeing method using this composition L'OREAL (FR) 2006-06-13 US claimed
US-20060021156-A1 Composition for the oxidation dyeing of keratinous fibres containing a laccase and dyeing method using this composition L'OREAL S.A. 2006-02-02 US claimed
US-20040255401-A1 Composition for the oxidation dyeing of keratinous fibres containing a laccase and dyeing method using this composition L'OREAL 2004-12-23 US claimed
CN-1440267-A Oxidation dyeing composition for keratinous fibres comprising amphoteric polymer with fatty chain OREAL (FR) 2003-09-03 CN claimed
US-6599329-B1 Composition for oxidation dyeing of keratinous fibers comprising colorant chosen from oxidation bases and their acid addition salts, coupler chosen from 2-amino-3-hydroxypyridine and its acid addition salts, and laccase enzyme L'OREAL S.A. (FR) 2003-07-29 US claimed
EP-0874615-B1 COLORANTS FOR COLOURING KERATIN FIBRES WELLA AG (DE) 2003-04-02 EP claimed
US-6537328-B1 Hair dye L'OREAL S.A. (FR) 2003-03-25 US claimed
CN-1262923-A Composit for oxidation dyeing keratin fibre and dyeing method using said composit OREAL (FR) 2000-08-16 CN claimed
EP-0874615-A1 COLORANTS FOR COLOURING KERATIN FIBRES Wella Aktiengesellschaft (DE) 1998-11-04 EP claimed
WO-1998019661-A1 COLORANTS FOR COLOURING KERATIN FIBRES WELLA AKTIENGESELLSCHAFT (DE) 1998-05-14 WO claimed
EP-0460128-A1 AGENT AND PROCESS FOR THE OXIDATIVE DYEING OF HAIR. WELLA AG (DE) 1991-12-11 EP claimed
WO-1991009587-A1 AGENT AND PROCESS FOR THE OXIDATIVE DYEING OF HAIR WELLA AKTIENGESELLSCHAFT (DE) 1991-07-11 WO claimed
CN-101137345-B Novel hair coloring compositions for oxidative hair dyeing PROCTER & GAMBLE 2012-10-31 CN disclosed
US-8241370-B2 Composition comprising an alkanolamine, a basic amino acid and a suitably selected additional alkaline agent L'OREAL S.A. (FR) 2012-08-14 US disclosed
US-8012220-B2 Specific monocationic monochromophoric compounds of hydrazone type comprising a 2-, 4-pyridinium or 2-, 4-quinolinium unit, synthesis thereof, dye compositions containing them, and method for dyeing keratin fibres L'OREAL S.A. (FR) 2011-09-06 US disclosed
EP-0505528-A1 HAIR COLORANT CONTAINING 1,4-BIS- (DIHYDROXYALKYL)AMINO]-ANTHRACHINONE AND NOVEL 1,4-BIS- (DIHYDROXYALKYL)AMINO)]-ANTHRACHINONES Wella Aktiengesellschaft (DE) 1992-09-30 EP disclosed
WO-1992006670-A1 HAIR COLORANT CONTAINING 1,4-BIS-[(DIHYDROXYALKYL)AMINO]-ANTHRACHINONE AND NOVEL 1,4-BIS-[(DIHYDROXYALKYL)AMINO)]-ANTHRACHINONES WELLA AKTIENGESELLSCHAFT (DE) 1992-04-30 WO disclosed
EP-0395837-A1 Oxidation hair dyes based on 4-aminophenol derivatives as well as new 4-aminophenol derivatives Wella Aktiengesellschaft (DE) 1990-11-07 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040255401-A1 Composition for the oxidation dyeing of keratinous fibres containing a laccase and dyeing method using this composition ALDH7A1, KRT18, LPO ALDH1A1 170/4885TDP1 1433/4885GAA 1814/4885
US-20060021156-A1 Composition for the oxidation dyeing of keratinous fibres containing a laccase and dyeing method using this composition TYR, KRT18, LPO ALDH1A1 195/4885TDP1 2164/4885GAA 2271/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.