SCHEMBL5705105

SCHEMBL5705105

Nc1ccc(-c2ccsc2C=O)c(O)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.38
KDM4E B2RXH2 3/20 0.38
MAPT P10636 3/20 0.38
ALDH1A1 P00352 3/20 0.38
GAA P10253 2/20 0.38
ESR2 Q92731 1/20 0.38
PTPN1 P18031 1/20 0.38
CASP1 P29466 2/20 0.37
TSHR P16473 2/20 0.37
TDP1 Q9NUW8 3/20 0.36
ALOX15 P16050 2/20 0.36
HSD17B10 Q99714 2/20 0.36
MAPK1 P28482 2/20 0.36
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LCK P06239 3/20 0.35
PRKDC P78527 1/20 0.35
KDR P35968 2/20 0.34
MEN1 O00255 1/20 0.34
TNF P01375 1/20 0.34

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
SCHEMBL1381854 0.88 PDE10A (0.40) CYP3A4KDM4EMAPTALDH1A1GAA
SCHEMBL7459787 0.83 PRKDC (0.35) CYP3A4MAPTALDH1A1CASP1TSHR
SCHEMBL9696347 0.79 PRKDC (0.41) MAPTALDH1A1L3MBTL1PRKDCMEN1
SCHEMBL5704974 0.78 CASP1 (0.42) CYP3A4KDM4EMAPTALDH1A1GAA
SCHEMBL5704865 0.77 MAPT (0.36) CYP3A4KDM4EMAPTALDH1A1GAA
SCHEMBL5704935 0.75 CASP1 (0.48) CYP3A4KDM4EMAPTALDH1A1GAA
SCHEMBL5704936 0.75 CA1 (0.44) CYP3A4KDM4EMAPTALDH1A1GAA
SCHEMBL7456608 0.74 MEN1 (0.30) MEN1KMT2A
SCHEMBL483397 0.74 CASP1 (0.59) CYP3A4KDM4EMAPTALDH1A1GAA
SCHEMBL29484239 0.74 CASP1 (0.59) CYP3A4KDM4EMAPTALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7128764-B2 M-aminophenol derivatives and coloring agents containing them WELLA AG (DE) 2006-10-31 US claimed
EP-1419148-B1 M-AMINOPHENOL DERIVATIVES AND COLOURING AGENTS CONTAINING THEM WELLA AG (DE) 2006-09-13 EP claimed
US-20040237214-A1 M-aminophenol derivatives and coloring agents containing them Wella GmbH (DE) 2004-12-02 US claimed
EP-1419148-A1 M-AMINOPHENOL DERIVATIVES AND COLOURING AGENTS CONTAINING THEM Wella Aktiengesellschaft (DE) 2004-05-19 EP claimed
WO-2003018571-A1 M-AMINOPHENOL DERIVATIVES AND COLOURING AGENTS CONTAINING THEM WELLA AKTIENGESELLSCHAFT (DE) 2003-03-06 WO claimed
US-7128764-B2 M-aminophenol derivatives and coloring agents containing them WELLA AG (DE) 2006-10-31 US disclosed
EP-1419148-B1 M-AMINOPHENOL DERIVATIVES AND COLOURING AGENTS CONTAINING THEM WELLA AG (DE) 2006-09-13 EP disclosed
US-20040237214-A1 M-aminophenol derivatives and coloring agents containing them Wella GmbH (DE) 2004-12-02 US disclosed
EP-1419148-A1 M-AMINOPHENOL DERIVATIVES AND COLOURING AGENTS CONTAINING THEM Wella Aktiengesellschaft (DE) 2004-05-19 EP disclosed
WO-2003018571-A1 M-AMINOPHENOL DERIVATIVES AND COLOURING AGENTS CONTAINING THEM WELLA AKTIENGESELLSCHAFT (DE) 2003-03-06 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-20040237214-A1 M-aminophenol derivatives and coloring agents containing them ALPP, RB1, TYR CYP3A4 220/4885KDM4E 1415/4885MAPT 1725/4885

“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.