SCHEMBL6137037

SCHEMBL6137037

CC(=O)c1csc(-c2cc(N)ccc2O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.44
PDE10A Q9Y233 1/20 0.41
KDM4C Q9H3R0 2/20 0.40
HSD17B1 P14061 2/20 0.39
HSD17B2 P37059 1/20 0.39
KDM4E B2RXH2 6/20 0.38
ALDH1A1 P00352 4/20 0.38
CASP1 P29466 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
HSD17B10 Q99714 3/20 0.38
TDP1 Q9NUW8 3/20 0.38
THRB P10828 2/20 0.38
ALOX15 P16050 2/20 0.38
CASP7 P55210 2/20 0.38
CYP3A4 P08684 2/20 0.38
TNF P01375 1/20 0.38
HSPD1 P10809 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 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
SCHEMBL5705033 0.89 CA2 (0.45) CA2PDE10AKDM4CHSD17B1HSD17B2
SCHEMBL7807362 0.86 CA2 (0.41) CA2HSD17B1HSD17B2KDM4EALDH1A1
SCHEMBL6136783 0.78 PDE10A (0.50) CA2PDE10AKDM4CHSD17B1HSD17B2
SCHEMBL6136947 0.74 CA1 (0.46) CA2PDE10AKDM4CKDM4EALDH1A1
SCHEMBL6136958 0.74 LCK (0.38) CA2PDE10AKDM4CKDM4EALDH1A1
SCHEMBL6136853 0.74 KDM4E (0.44) PDE10AKDM4CHSD17B1HSD17B2KDM4E
SCHEMBL1381310 0.73 PDE10A (0.41) CA2PDE10AKDM4CKDM4EALDH1A1
SCHEMBL1380335 0.72 KDM4E (0.43) CA2PDE10AKDM4CKDM4EALDH1A1
SCHEMBL5712475 0.72 CA2 (0.43) CA2HSD17B1HSD17B2KDM4EALDH1A1
SCHEMBL6136824 0.72 ALOX15 (0.49) PDE10AKDM4CKDM4EALDH1A1MEN1

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 CA2 3119/4885PDE10A 3344/4885KDM4C 125/4885

“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.