SCHEMBL20161711

SCHEMBL20161711

CCCNC(=O)CC1OC[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BCHE P06276 3/20 0.43
FUCA1 P04066 1/20 0.36
MCL1 Q07820 1/20 0.36
GBA1 P04062 2/20 0.34
EPHX1 P07099 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
PYGB P11216 1/20 0.32
SPHK2 Q9NRA0 1/20 0.31
SPHK1 Q9NYA1 1/20 0.31
EPHX2 P34913 1/20 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
SCHEMBL20161449 0.88 CASP2 (0.46) BCHEFUCA1EPHX1SPHK2SPHK1
SCHEMBL21342122 0.80 THRB (0.33) ALDH1A1LMNAGAAPYGB
SCHEMBL21342381 0.77
SCHEMBL22757339 0.76 THRB (0.33) ALDH1A1LMNA
SCHEMBL20161691 0.74 FUCA1 (0.42) BCHEFUCA1MCL1GAAPYGB
SCHEMBL20161703 0.74 PYGB (0.51) FUCA1GAAPYGB
SCHEMBL10015241 0.73 THRB (0.32) FUCA1LMNASPHK2SPHK1
SCHEMBL1900467 0.73 THRB (0.32) FUCA1LMNASPHK2SPHK1
SCHEMBL16994826 0.73 THRB (0.32) FUCA1LMNASPHK2SPHK1
SCHEMBL3294716 0.73 THRB (0.32) FUCA1LMNASPHK2SPHK1

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 BCHE 943/4885FUCA1 58/4885MCL1 4443/4885
US-11045411-B2 Process for treating keratin materials using amide, acid or ester c-glycoside derivatives, and cosmetic composition containing same KRT18, CUTA, GLA BCHE 943/4885FUCA1 58/4885MCL1 4443/4885

“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.