SCHEMBL6068029

SCHEMBL6068029

Oc1ccc(-c2sccc2Cl)c(O)c1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 12/20 0.61
ESR2 Q92731 9/20 0.61
HSD17B10 Q99714 1/20 0.40
TYR P14679 1/20 0.40
ALOX5 P09917 1/20 0.39
MAOA P21397 1/20 0.38
UGT1A1 P22309 1/20 0.38
MAOB P27338 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
SCHEMBL29085030 0.89 ESR1 (0.77) ESR1ESR2HSD17B10MAOAUGT1A1
SCHEMBL5704963 0.81 CA1 (0.47) ESR1ESR2HSD17B10
SCHEMBL6068334 0.77 ESR1 (0.47) ESR1ESR2TYRALOX5
SCHEMBL6067884 0.77 ESR1 (0.47) ESR1ESR2HSD17B10
SCHEMBL6067913 0.74 ESR1 (0.53) ESR1ESR2HSD17B10TYRALOX5
SCHEMBL6067912 0.74 ESR1 (0.53) ESR1ESR2HSD17B10TYRALOX5
SCHEMBL29085004 0.73 ESR1 (0.70) ESR1ESR2HSD17B10
SCHEMBL6137031 0.73 CA1 (0.50) ESR1ESR2HSD17B10
SCHEMBL6067868 0.72 ESR1 (0.46) ESR1ESR2HSD17B10
SCHEMBL9773297 0.71 RAB9A (0.47) ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100349886-C 1, 3-dihydroxybenzene derivatives and coloring agents containing the same WELLA AG (US) 2007-11-21 CN disclosed
US-7125428-B2 1,3-Dihydroxybenzene derivatives and colorants containing said compounds WELLA AG (DE) 2006-10-24 US disclosed
CN-1633426-A 1, 3-dihydroxybenzene derivatives and coloring agents containing the same WELLA AG (US) 2005-06-29 CN disclosed
EP-1392673-B1 1,3-DIHYDROXYBENZENE DERIVATIVES AND COLORANTS CONTAINING SAID COMPOUNDS WELLA AG (DE) 2005-06-08 EP disclosed
US-20040016063-A1 1,3-Dihydroxybenzene derivatives and colorants containing said compounds HFC PRESTIGE INTERNATIONAL HOLDING SWITZERLAND S.A.R.L (CH) 2004-01-29 US 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-20040016063-A1 1,3-Dihydroxybenzene derivatives and colorants containing said compounds KRT18, DSP, COL1A1 ESR1 2061/4885ESR2 1641/4885HSD17B10 1107/4885

“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.