SCHEMBL2201431

SCHEMBL2201431

CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 4/20 0.59
CETP P11597 1/20 0.50
MGLL Q99685 1/20 0.46
DUSP3 P51452 1/20 0.46
PTPN7 P35236 1/20 0.46

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
SCHEMBL2196892 1.00 TLR4 (0.59) TLR4CETPMGLLDUSP3PTPN7
SCHEMBL1758430 1.00 TLR4 (0.59) TLR4CETPMGLLDUSP3PTPN7
SCHEMBL5436079 1.00 TLR4 (0.59) TLR4CETPMGLLDUSP3PTPN7
SCHEMBL2196896 1.00 TLR4 (0.59) TLR4CETPMGLLDUSP3PTPN7
SCHEMBL2196886 1.00 TLR4 (0.59) TLR4CETPMGLLDUSP3PTPN7
SCHEMBL2598250 0.96 TLR4 (0.57) TLR4CETP
SCHEMBL2200475 0.96 TLR4 (0.57) TLR4CETP
SCHEMBL28470234 0.96 TLR4 (0.57) TLR4CETP
SCHEMBL15540605 0.96 TLR4 (0.57) TLR4CETP
SCHEMBL65627 0.96 TLR4 (0.57) TLR4CETP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8729254-B2 Derivative of glucose and vitamin F, compositions comprising it, uses and preparation process L'OREAL (FR) 2014-05-20 US disclosed
US-7977318-B2 Derivative of glucose and of vitamin F, compositions comprising it, uses and preparation process L'OREAL S.A. (FR) 2011-07-12 US disclosed
US-7795230-B2 Derivative of glucose and of vitamin F, compositions comprising it, uses and preparation process L'OREAL S.A. (FR) 2010-09-14 US disclosed
US-7763587-B2 Derivative of glucose and of vitamin F, compositions comprising it, uses and preparation process L'OREAL S.A. (FR) 2010-07-27 US disclosed
US-20090149396-A1 DERIVATIVE OF GLUCOSE AND VITAMIN F, COMPOSITIONS COMPRISING IT, USES AND PREPARATION PROCESS L'OREAL S.A. 2009-06-11 US disclosed
CN-101386875-A Synthesis of conjugate linoleate sugar esters derivates based on enzymatic method UNIV HENAN NORMAL (CN) 2009-03-18 CN disclosed
US-20070123471-A1 Derivative of glucose and of vitamin F, compositions comprising it, uses and preparation process L'OREAL S.A. 2007-05-31 US disclosed
US-20060165630-A1 Use of amide or ester of sugar and of fatty acid, for treating and/or preventing dry skin L'OREAL (FR) 2006-07-27 US disclosed
US-20060166902-A1 Derivative of glucose and of vitamin F, compositions comprising it, uses and preparation process L'OREAL S.A. 2006-07-27 US disclosed
EP-1551362-A2 USE OF AMIDE OR ESTER OF SUGAR AND OF FATTY ACID, FOR TREATING AND/OR PREVENTING DRY SKIN. L'OREAL (FR) 2005-07-13 EP disclosed
WO-2004034958-A2 USE OF AMIDE OR ESTER OF SUGAR AND OF FATTY ACID, FOR TREATING AND/OR PREVENTING DRY SKIN L'OREAL (FR) 2004-04-29 WO disclosed
US-20040038912-A1 Derivative of glucose and of vitamin F, compositions comprising it, uses and preparation process L'OREAL S.A. (FR) 2004-02-26 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 (5 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-20060166902-A1 Derivative of glucose and of vitamin F, compositions comprising it, uses and preparation process FASN, ELOVL6, ACSL6 TLR4 2674/4885CETP 1496/4885MGLL 349/4885
US-20090149396-A1 DERIVATIVE OF GLUCOSE AND VITAMIN F, COMPOSITIONS COMPRISING IT, USES AND PREPARATION PROCESS FASN, ELOVL6, FADS2 TLR4 2700/4885CETP 1466/4885MGLL 327/4885
US-20070123471-A1 Derivative of glucose and of vitamin F, compositions comprising it, uses and preparation process FASN, ELOVL6, ACSL6 TLR4 2674/4885CETP 1496/4885MGLL 349/4885
US-20040038912-A1 Derivative of glucose and of vitamin F, compositions comprising it, uses and preparation process FASN, ELOVL6, ACSL6 TLR4 2674/4885CETP 1496/4885MGLL 349/4885
US-20060165630-A1 Use of amide or ester of sugar and of fatty acid, for treating and/or preventing dry skin CUTA, SCD5, SCD TLR4 685/4885CETP 654/4885MGLL 188/4885

“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.