SCHEMBL20161913

SCHEMBL20161913

CNC(=O)C(C)C1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.36
CA2 P00918 4/20 0.35
CA9 Q16790 2/20 0.35
CA12 O43570 1/20 0.35
FUCA1 P04066 1/20 0.35
SELL P14151 6/20 0.32
SELP P16109 6/20 0.32
CA1 P00915 3/20 0.31

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
SCHEMBL20161919 0.82 SMN1; SMN2 (0.36) SMN1; SMN2CA2CA9CA12FUCA1
SCHEMBL20161901 0.79 CA9 (0.34) SMN1; SMN2CA2CA9CA12FUCA1
SCHEMBL20161694 0.79 FUCA1 (0.37) CA2CA9CA12FUCA1
SCHEMBL20161561 0.78 PYGB (0.43) CA2CA9CA12CA1
SCHEMBL20161908 0.78 PYGB (0.43) CA2CA9CA12CA1
SCHEMBL20161563 0.78 PYGB (0.43) CA2CA9CA12CA1
SCHEMBL20161420 0.75 MMP8 (0.42)
SCHEMBL20161683 0.75 MMP8 (0.42)
SCHEMBL20161308 0.74 FUCA1 (0.31) CA2CA9CA12FUCA1SELP
SCHEMBL30590234 0.73 FUCA1 (0.42) SMN1; SMN2CA2CA9CA12FUCA1

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 SMN1; SMN2 4796/4885CA2 1939/4885CA9 451/4885
US-11045411-B2 Process for treating keratin materials using amide, acid or ester c-glycoside derivatives, and cosmetic composition containing same KRT18, CUTA, GLA SMN1; SMN2 4796/4885CA2 1939/4885CA9 451/4885

“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.