SCHEMBL6573352

SCHEMBL6573352

Nc1ccc(O)c(-c2cccc(Cl)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.55
ESR2 Q92731 1/20 0.54
ALDH1A1 P00352 2/20 0.50
FYN P06241 1/20 0.48
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
PIK3CA P42336 2/20 0.47
ALOX15 P16050 2/20 0.47
ALOX12 P18054 2/20 0.47
TDO2 P48775 1/20 0.46
DHFR P00374 1/20 0.45
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43
HPGD P15428 1/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PDE10A Q9Y233 1/20 0.42
ADORA2A P29274 1/20 0.42
ADORA1 P30542 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
SCHEMBL5687745 0.87 ALDH1A1 (0.52) ALOX5ESR2ALDH1A1FYNCA1
Hydrochloric Acid SCHEMBL5684866 0.86 ALDH1A1 (0.50) ALOX5ESR2ALDH1A1FYNCA1
SCHEMBL5094107 0.85 ALOX5 (0.62) ALOX5ESR2ALDH1A1CA1CA2
SCHEMBL3784572 0.85 MCL1 (0.51) ALDH1A1CA1CA2ALOX15CA12
SCHEMBL10706273 0.83 ALDH1A1 (0.56) ALOX5ESR2ALDH1A1ALOX12TDO2
SCHEMBL6571989 0.81 ALDH1A1 (0.54) ALOX5ESR2ALDH1A1ALOX15TDO2
SCHEMBL21770705 0.81 ALDH1A1 (0.54) ALOX5ESR2ALDH1A1TDO2DHFR
SCHEMBL6572438 0.81 PIK3CG (0.56) ALDH1A1CA1CA2CA12CA9
SCHEMBL11741430 0.81 ALOX5 (0.58) ALOX5ESR2FYNPIK3CAALOX15
Hydrochloric Acid SCHEMBL6776875 0.80 PIK3CG (0.54) ALDH1A1CA1CA2CA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 ALOX5 358/4885ESR2 948/4885ALDH1A1 20/4885

“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.