SCHEMBL5086794

SCHEMBL5086794

CC(C)N(C(=O)Cc1ccc(N)c(O)c1)C(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.49
KDM4E B2RXH2 5/20 0.49
POLB P06746 3/20 0.49
MAPT P10636 3/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
RAB9A P51151 2/20 0.49
ALDH1A1 P00352 5/20 0.42
GFER P55789 1/20 0.42
HSD17B10 Q99714 5/20 0.39
HPGD P15428 5/20 0.39
HIF1A Q16665 3/20 0.39
LMNA P02545 2/20 0.39
NFKB1 P19838 2/20 0.39
THPO P40225 2/20 0.39
BLM P54132 2/20 0.39
PMP22 Q01453 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
RGS12 O14924 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL5094928 0.82 GAA (0.53) GAAKDM4EPOLBMAPTMEN1
SCHEMBL5086740 0.79 GAA (0.50) GAAKDM4EPOLBMAPTMEN1
SCHEMBL15651246 0.78 OPRK1 (0.43) POLBALDH1A1GFERLMNATDP1
SCHEMBL5094934 0.77 POLB (0.56) GAAKDM4EPOLBMAPTMEN1
SCHEMBL15887321 0.76 GAA (0.59) GAAKDM4EPOLBMAPTMEN1
SCHEMBL5088874 0.75 GAA (0.49) GAAKDM4EPOLBMAPTMEN1
SCHEMBL5094906 0.75 GAA (0.49) GAAKDM4EPOLBMAPTMEN1
SCHEMBL5088786 0.75 POLB (0.47) GAAKDM4EPOLBMAPTMEN1
Phosphoric Acid SCHEMBL5430756 0.75 GAA (0.45) GAAKDM4EPOLBMAPTMEN1
SCHEMBL1357940 0.74 GAA (0.61) GAAKDM4EPOLBMAPTMEN1

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
JP-2008510738-A 2008-04-10 JP claimed
EP-1781597-A1 O-AMINOPHENOL DERIVATIVES AND DYES CONTAINING THESE COMPOUNDS Wella Aktiengesellschaft (DE) 2007-05-09 EP claimed
US-20070099959-A1 O-Aminophenol derivatives and colorants containing these compounds THE PROCTER & GAMBLE COMPANY (US) 2007-05-03 US claimed
WO-2006021256-A1 O-AMINOPHENOL DERIVATIVES AND DYES CONTAINING THESE COMPOUNDS WELLA AKTIENGESELLSCHAFT (DE) 2006-03-02 WO claimed
US-20070099959-A1 O-Aminophenol derivatives and colorants containing these compounds THE PROCTER & GAMBLE COMPANY (US) 2007-05-03 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-20070099959-A1 O-Aminophenol derivatives and colorants containing these compounds KRT18, TYR, ALPG GAA 4376/4885KDM4E 586/4885POLB 1283/4885

“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.