SCHEMBL20161280

SCHEMBL20161280

CCCCCCNC(=O)SC1OC[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 14/20 0.41
EPHX2 P34913 2/20 0.40
GNAI3 P08754 1/20 0.40
GNAO1 P09471 1/20 0.40
GNAI1 P63096 1/20 0.40

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
SCHEMBL20161710 0.78 FUCA1 (0.47) EPHX1
SCHEMBL20161455 0.76 LGALS3 (0.44) EPHX1EPHX2
SCHEMBL20161631 0.76 LGALS3 (0.44) EPHX1EPHX2
SCHEMBL20161940 0.75 GBA2 (0.44) EPHX1
SCHEMBL20161326 0.74 TDP1 (0.31)
SCHEMBL20161449 0.73 CASP2 (0.46) EPHX1EPHX2
SCHEMBL20161281 0.71 MMP8 (0.42) EPHX1EPHX2GNAI3GNAO1GNAI1
SCHEMBL20161448 0.71 MMP8 (0.42) EPHX1EPHX2GNAI3GNAO1GNAI1
SCHEMBL10816000 0.71 GBA1 (0.40)
SCHEMBL3441483 0.71 GBA1 (0.40)

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 EPHX1 2974/4885EPHX2 1855/4885GNAI3 4455/4885
US-11045411-B2 Process for treating keratin materials using amide, acid or ester c-glycoside derivatives, and cosmetic composition containing same KRT18, CUTA, GLA EPHX1 2974/4885EPHX2 1855/4885GNAI3 4455/4885

“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.