SCHEMBL5705083

SCHEMBL5705083

Nc1ccc(-c2csc(Cl)c2)c(O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
ESR2 Q92731 4/20 0.40
ESR1 P03372 3/20 0.40
TSHR P16473 2/20 0.38
CASP1 P29466 2/20 0.38
CYP3A4 P08684 3/20 0.35
KDM4E B2RXH2 3/20 0.35
MAPT P10636 2/20 0.35
GAA P10253 2/20 0.35
ALDH1A1 P00352 2/20 0.35
PTPN1 P18031 1/20 0.35
PDE10A Q9Y233 1/20 0.34
TYR P14679 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
ALOX15 P16050 2/20 0.33
HSD17B10 Q99714 2/20 0.33
POLB P06746 1/20 0.33
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL1382296 0.88 CA1 (0.46) CA1CA2ESR2ESR1TSHR
SCHEMBL5704919 0.81 CASP1 (0.41) CA1CA2ESR2ESR1TSHR
SCHEMBL7457854 0.80 CYP3A4 (0.35) CA1CA2ESR2ESR1TSHR
SCHEMBL27591271 0.79 ESR2 (0.40) CA1CA2ESR2ESR1TSHR
SCHEMBL5704944 0.79 TSHR (0.47) CA1CA2ESR2ESR1TSHR
SCHEMBL5704948 0.76 KDM4E (0.37) CA1CA2ESR2ESR1TSHR
SCHEMBL5704785 0.73 MAPT (0.41) ESR2TSHRCASP1CYP3A4KDM4E
SCHEMBL5704907 0.73 ALOX15 (0.47) ESR2TSHRCASP1CYP3A4KDM4E
SCHEMBL5684627 0.73 CA1 (0.48) CA1CA2ESR2TSHRCASP1
SCHEMBL5688051 0.73 CA1 (0.48) CA1CA2ESR2TSHRCASP1

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-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
CN-100358887-C m-aminophenol derivatives and dyes containing these compounds P & G CLAIROL INC (US) 2008-01-02 CN disclosed
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
CN-1551875-A m-aminophenol derivatives and dyes containing these compounds P&G 2004-12-01 CN 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 CA1 3146/4885CA2 1282/4885ESR2 177/4885

“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.