SCHEMBL6574009

SCHEMBL6574009

Nc1ccc(O)c(-c2ccc(O)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 2/20 0.50
THRB P10828 2/20 0.50
PELI1 Q96FA3 1/20 0.50
ALDH1A1 P00352 1/20 0.50
CA3 P07451 1/20 0.50
CYP3A4 P08684 1/20 0.50
ALOX15 P16050 1/20 0.50
CA6 P23280 1/20 0.50
CASP1 P29466 1/20 0.50
HIF1A Q16665 1/20 0.50
HSD17B10 Q99714 1/20 0.50
CA14 Q9ULX7 1/20 0.50
PDE10A Q9Y233 1/20 0.50
ALOX5 P09917 1/20 0.46
APP P05067 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
BACE1 P56817 2/20 0.43
ESR1 P03372 4/20 0.42
TP53 P04637 1/20 0.42

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
Hydrochloric Acid SCHEMBL6782855 0.98 PELI1 (0.49) USP7THRBPELI1ALDH1A1CA3
SCHEMBL3789852 0.91 PDE10A (0.54) THRBPELI1ALDH1A1CA3CYP3A4
Hydrochloric Acid SCHEMBL6787402 0.89 PDE10A (0.52) THRBPELI1ALDH1A1CA3CYP3A4
SCHEMBL11583585 0.87 ALDH1A1 (0.50) USP7THRBPELI1ALDH1A1CA3
SCHEMBL5685027 0.84 CASP1 (0.52) USP7THRBALDH1A1CA3CYP3A4
SCHEMBL2185234 0.83 CA1 (0.52) ALDH1A1ALOX15HSD17B10PDE10AALOX5
SCHEMBL6573823 0.83 PDE10A (0.47) THRBALDH1A1CYP3A4ALOX15CASP1
SCHEMBL6029104 0.83 BACE1 (0.62) ALDH1A1ALOX15CASP1HSD17B10PDE10A
SCHEMBL900806 0.83 BACE1 (0.62) THRBPELI1ALDH1A1CYP3A4ALOX15
SCHEMBL30230742 0.83 BACE1 (0.62) THRBPELI1ALDH1A1CYP3A4ALOX15

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6749644-B2 DEVELOPER AND COUPLER; WIDE RANGE OF DIFFERENT COLOR SHADES FROM BLOND TO BROWN, PURPLE, VIOLET AND EVEN BLUE AND BLACK; INTENSITY WELLA AKTIENGESELLSCHAFT (DE) 2004-06-15 US claimed
EP-1208077-B1 2-HYDROXY-5-AMINO-BIPHENYL-DERIVATIVES AND OXIDATIVE HAIR COLOURING AGENTS CONTAINING SAID COMPOUNDS WELLA AG (DE) 2004-04-21 EP claimed
US-20020166180-A1 2-hydroxy-5-amino-biphenyl-derivatives and oxidative hair colouring agents containing said compounds HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2002-11-14 US claimed
EP-1208077-A1 2-HYDROXY-5-AMINO-BIPHENYL-DERIVATIVES AND OXIDATIVE HAIR COLOURING AGENTS CONTAINING SAID COMPOUNDS Wella Aktiengesellschaft (DE) 2002-05-29 EP claimed
WO-2002002507-A1 2-HYDROXY-5-AMINO-BIPHENYL-DERIVATIVES AND OXIDATIVE HAIR COLOURING AGENTS CONTAINING SAID COMPOUNDS WELLA AKTIENGESELLSCHAFT (DE) 2002-01-10 WO claimed
CN-101242876-B Oxidizing hair coloring agents containing m-aminophenol derivatives PROCTER & GAMBLE 2011-05-11 CN disclosed
CN-101257886-A Agent for simultaneous lightening and coloring of keratin fibres containing a sulfamate bleach booster PROCTER & GAMBLE (US) 2008-09-03 CN disclosed
US-6749644-B2 DEVELOPER AND COUPLER; WIDE RANGE OF DIFFERENT COLOR SHADES FROM BLOND TO BROWN, PURPLE, VIOLET AND EVEN BLUE AND BLACK; INTENSITY WELLA AKTIENGESELLSCHAFT (DE) 2004-06-15 US disclosed
EP-1208077-B1 2-HYDROXY-5-AMINO-BIPHENYL-DERIVATIVES AND OXIDATIVE HAIR COLOURING AGENTS CONTAINING SAID COMPOUNDS WELLA AG (DE) 2004-04-21 EP disclosed
US-20020166180-A1 2-hydroxy-5-amino-biphenyl-derivatives and oxidative hair colouring agents containing said compounds HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2002-11-14 US disclosed
EP-1208077-A1 2-HYDROXY-5-AMINO-BIPHENYL-DERIVATIVES AND OXIDATIVE HAIR COLOURING AGENTS CONTAINING SAID COMPOUNDS Wella Aktiengesellschaft (DE) 2002-05-29 EP disclosed
WO-2002002507-A1 2-HYDROXY-5-AMINO-BIPHENYL-DERIVATIVES AND OXIDATIVE HAIR COLOURING AGENTS CONTAINING SAID COMPOUNDS WELLA AKTIENGESELLSCHAFT (DE) 2002-01-10 WO 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 (1 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-20020166180-A1 2-hydroxy-5-amino-biphenyl-derivatives and oxidative hair colouring agents containing said compounds AHR, KRT18, HMOX2 USP7 1740/4885THRB 1830/4885PELI1 1453/4885

“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.