SCHEMBL20161930

SCHEMBL20161930

CCCCCCCCCCCCCCNC(=O)C(O)C1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.42
MAPK1 P28482 1/20 0.41
PYGB P11216 2/20 0.40
FNTA P49354 1/20 0.40
FNTB P49356 1/20 0.40
NAAA Q02083 2/20 0.39
GAA P10253 1/20 0.39
RRM1 P23921 1/20 0.39
DPP7 Q9UHL4 1/20 0.38
EPHX1 P07099 2/20 0.38
CTSK P43235 1/20 0.38
METAP2 P50579 1/20 0.38
GNAI3 P08754 1/20 0.37
GNAO1 P09471 1/20 0.37
GNAI1 P63096 1/20 0.37

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
SCHEMBL20161696 1.00 EPHX2 (0.42) EPHX2MAPK1PYGBFNTAFNTB
SCHEMBL20161577 0.89 PYGB (0.43) PYGBGAA
SCHEMBL20161459 0.89 PYGB (0.43) PYGBGAA
SCHEMBL18214272 0.89 PYGB (0.43) PYGBGAA
SCHEMBL20161460 0.88 GJB2 (0.46) MAPK1
SCHEMBL14246731 0.88 NAAA (0.42) FNTAFNTBNAAARRM1DPP7
SCHEMBL20161932 0.87 EPHX2 (0.42) EPHX2MAPK1PYGBFNTAFNTB
SCHEMBL20161322 0.87 EPHX2 (0.42) EPHX2MAPK1PYGBFNTAFNTB
SCHEMBL20161921 0.87 EPHX2 (0.42) EPHX2MAPK1PYGBFNTAFNTB
SCHEMBL20161562 0.87 EPHX2 (0.42) EPHX2MAPK1PYGBFNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11045411-B2 Process for treating keratin materials using amide, acid or ester c-glycoside derivatives, and cosmetic composition containing same L'OREAL (FR) 2021-06-29 US disclosed
US-20180133137-A1 PROCESS FOR TREATING KERATIN MATERIALS USING AMIDE, ACID OR ESTER C-GLYCOSIDE DERIVATIVES, AND COSMETIC COMPOSITION CONTAINING SAME L'OREAL (FR) 2018-05-17 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 (2 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-20180133137-A1 PROCESS FOR TREATING KERATIN MATERIALS USING AMIDE, ACID OR ESTER C-GLYCOSIDE DERIVATIVES, AND COSMETIC COMPOSITION CONTAINING SAME KRT18, CUTA, GLA EPHX2 1855/4885MAPK1 2735/4885PYGB 3409/4885
US-11045411-B2 Process for treating keratin materials using amide, acid or ester c-glycoside derivatives, and cosmetic composition containing same KRT18, CUTA, GLA EPHX2 1855/4885MAPK1 2735/4885PYGB 3409/4885

“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.