SCHEMBL20161404

SCHEMBL20161404

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nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PYGB P11216 4/20 0.38
ALDH1A1 P00352 1/20 0.37
THRB P10828 1/20 0.37
MAPK1 P28482 1/20 0.36
SYNJ2 O15056 1/20 0.36
LGALS1 P09382 1/20 0.36
LGALS3 P17931 1/20 0.36
KDR P35968 1/20 0.35
GAA P10253 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SLC28A3 Q9HAS3 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL20161668 1.00 PYGB (0.38) PYGBALDH1A1THRBMAPK1SYNJ2
SCHEMBL20161451 1.00 PYGB (0.38) PYGBALDH1A1THRBMAPK1SYNJ2
SCHEMBL20161574 0.89 LGALS3 (0.42) SYNJ2LGALS1LGALS3
SCHEMBL18214230 0.86 SYNJ2 (0.39) PYGBALDH1A1THRBMAPK1SYNJ2
SCHEMBL20158779 0.86 SYNJ2 (0.39) PYGBALDH1A1THRBMAPK1SYNJ2
SCHEMBL18214252 0.86 SYNJ2 (0.39) PYGBALDH1A1THRBMAPK1SYNJ2
SCHEMBL20161667 0.85 PYGB (0.38) PYGBALDH1A1THRBMAPK1SYNJ2
SCHEMBL20161569 0.83 FUCA1 (0.33) ALDH1A1
SCHEMBL20161570 0.82 PYGB (0.42) PYGBALDH1A1THRBMAPK1LGALS1
SCHEMBL20161450 0.82 PYGB (0.42) PYGBALDH1A1THRBMAPK1LGALS1

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 PYGB 3409/4885ALDH1A1 2183/4885THRB 3657/4885
US-11045411-B2 Process for treating keratin materials using amide, acid or ester c-glycoside derivatives, and cosmetic composition containing same KRT18, CUTA, GLA PYGB 3409/4885ALDH1A1 2183/4885THRB 3657/4885

“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.