SCHEMBL20158779

SCHEMBL20158779

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

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SYNJ2 O15056 1/20 0.39
PYGB P11216 4/20 0.38
GAA P10253 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 1/20 0.34
THRB P10828 1/20 0.34
MAPT P10636 1/20 0.34
SLC28A3 Q9HAS3 2/20 0.34
MAPK1 P28482 1/20 0.34
KDR P35968 1/20 0.33
LGALS3 P17931 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
SCHEMBL18214230 1.00 SYNJ2 (0.39) SYNJ2PYGBGAAL3MBTL1ALDH1A1
SCHEMBL18214252 1.00 SYNJ2 (0.39) SYNJ2PYGBGAAL3MBTL1ALDH1A1
SCHEMBL18214277 0.89 LGALS3 (0.42) SYNJ2LGALS3
SCHEMBL20161451 0.86 PYGB (0.38) SYNJ2PYGBGAAL3MBTL1ALDH1A1
SCHEMBL20161404 0.86 PYGB (0.38) SYNJ2PYGBGAAL3MBTL1ALDH1A1
SCHEMBL20161668 0.86 PYGB (0.38) SYNJ2PYGBGAAL3MBTL1ALDH1A1
SCHEMBL20161667 0.85 PYGB (0.38) SYNJ2PYGBGAAL3MBTL1ALDH1A1
SCHEMBL20158773 0.83 FUCA1 (0.33) ALDH1A1
SCHEMBL18214269 0.82 PYGB (0.42) PYGBGAAALDH1A1THRBMAPT
SCHEMBL20158767 0.82 PYGB (0.42) PYGBGAAALDH1A1THRBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20180133137-A1 PROCESS FOR TREATING KERATIN MATERIALS USING AMIDE, ACID OR ESTER C-GLYCOSIDE DERIVATIVES, AND COSMETIC COMPOSITION CONTAINING SAME KRT18, CUTA, GLA SYNJ2 4129/4885PYGB 3409/4885GAA 271/4885

“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.