SCHEMBL6136941

SCHEMBL6136941

Nc1ccc(O)c(-c2cccs2)c1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.43
TYMP P19971 1/20 0.38
RPS6KB2 Q9UBS0 1/20 0.38
ERN1 O75460 1/20 0.37
HSD17B10 Q99714 3/20 0.36
POLB P06746 3/20 0.36
MAPT P10636 2/20 0.36
ALOX15 P16050 1/20 0.36
HDAC1 Q13547 5/20 0.36
HDAC2 Q92769 5/20 0.36
HDAC3 O15379 4/20 0.36
CSNK2A2 P19784 1/20 0.36
CSNK2B P67870 1/20 0.36
CSNK2A1 P68400 1/20 0.36
CSNK2A3 Q8NEV1 1/20 0.36
NPC1 O15118 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 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
SCHEMBL6136886 0.79 KCNH2 (0.43) KCNH2RPS6KB2ERN1HSD17B10POLB
SCHEMBL6067827 0.77 RPS6KB2 (0.47) KCNH2TYMPRPS6KB2ERN1HSD17B10
SCHEMBL5712500 0.77 KCNH2 (0.43) KCNH2RPS6KB2ERN1HSD17B10POLB
SCHEMBL6067926 0.76 RPS6KB2 (0.47) KCNH2TYMPRPS6KB2ERN1POLB
SCHEMBL6068128 0.75 TYMP (0.40) TYMPRPS6KB2ERN1HSD17B10POLB
Hydrochloric Acid SCHEMBL5712514 0.75 KCNH2 (0.42) KCNH2RPS6KB2ERN1HSD17B10POLB
SCHEMBL6068045 0.74 TMIGD3 (0.45) TYMPRPS6KB2ERN1HSD17B10POLB
SCHEMBL13319104 0.72 TYMP (0.50) KCNH2TYMPRPS6KB2HSD17B10POLB
SCHEMBL23522670 0.71 TYMP (0.48) KCNH2TYMPRPS6KB2HSD17B10POLB
SCHEMBL6288456 0.70 KCNH2 (0.46) KCNH2ERN1HSD17B10POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1153917-B1 p-Aminophenol derivatives and colorants containing them WELLA AG (DE) 2005-04-13 EP claimed
US-6592631-B2 Useful as developer compounds in oxidation dye compositions for keratin fibers. WELLA AG (DE) 2003-07-15 US claimed
US-20010054207-A1 p-aminophenol derivative compounds and dye compositions containing same WELLA INTERNATIONAL OPERATIONS SWITZERLAND SARL (CH) 2001-12-27 US claimed
EP-1153917-A1 p-Aminophenol derivatives and colorants containing them Wella Aktiengesellschaft (DE) 2001-11-14 EP claimed
EP-1153917-B1 p-Aminophenol derivatives and colorants containing them WELLA AG (DE) 2005-04-13 EP disclosed
US-6592631-B2 Useful as developer compounds in oxidation dye compositions for keratin fibers. WELLA AG (DE) 2003-07-15 US disclosed
US-20010054207-A1 p-aminophenol derivative compounds and dye compositions containing same WELLA INTERNATIONAL OPERATIONS SWITZERLAND SARL (CH) 2001-12-27 US disclosed
EP-1153917-A1 p-Aminophenol derivatives and colorants containing them Wella Aktiengesellschaft (DE) 2001-11-14 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 (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-20010054207-A1 p-aminophenol derivative compounds and dye compositions containing same KRT18, AASDHPPT, S100P KCNH2 1048/4885TYMP 2214/4885RPS6KB2 2986/4885

“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.