SCHEMBL6068098

SCHEMBL6068098

Cc1ccc(O)c(-c2cccs2)c1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.44
CTSG P08311 1/20 0.44
RPS6KB2 Q9UBS0 1/20 0.40
ERN1 O75460 2/20 0.39
TMIGD3 P0DMS9 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
TRPA1 O75762 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
PTGS1 P23219 2/20 0.37
PTGS2 P35354 2/20 0.37
ALOX5 P09917 1/20 0.37
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 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
SCHEMBL6068045 0.84 TMIGD3 (0.45) RPS6KB2ERN1TMIGD3ADORA2AADORA1
SCHEMBL6068128 0.78 TYMP (0.40) RPS6KB2ERN1TMIGD3ADORA2AADORA1
SCHEMBL6068140 0.77 ERN1 (0.56) RPS6KB2ERN1MEN1KMT2AALDH1A1
SCHEMBL481312 0.76 KDM4E (0.45) ERN1TMIGD3ADORA2AADORA1MEN1
SCHEMBL6067827 0.76 RPS6KB2 (0.47) RPS6KB2ERN1TMIGD3ADORA2AADORA1
SCHEMBL6136886 0.75 KCNH2 (0.43) RPS6KB2ERN1MEN1KMT2AALDH1A1
SCHEMBL6068012 0.73 MEN1 (0.48) ELANERPS6KB2ERN1MEN1KMT2A
SCHEMBL6068070 0.73 QPCT (0.42) ELANERPS6KB2ERN1MEN1KMT2A
SCHEMBL26259597 0.72 ACHE (0.42) MEN1KMT2ASMN1; SMN2TDP1ALDH1A1
SCHEMBL1133289 0.71 MGAM (0.47) MEN1KMT2ASMN1; SMN2TDP1ALDH1A1

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 4 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
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 ELANE 3233/4885CTSG 4639/4885RPS6KB2 2994/4885

“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.