SCHEMBL2959758

SCHEMBL2959758

CCCCCCCC/C=C\CCCCCCCC(=O)O[C@@H]1[C@@H](O)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O[C@H](CO)[C@H]1O

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 4/20 0.54
CETP P11597 1/20 0.48
SELP P16109 1/20 0.47
GJB2 P29033 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
SCHEMBL7532142 0.97 TLR4 (0.56) TLR4CETPSELP
SCHEMBL509203 0.97 TLR4 (0.50) TLR4CETPSELP
SCHEMBL2959757 0.94 TLR4 (0.54) TLR4CETPSELPGJB2
SCHEMBL4185270 0.93 LGALS8 (0.50) TLR4GJB2
SCHEMBL3393533 0.93 LGALS8 (0.50) TLR4GJB2
SCHEMBL4181285 0.93 LGALS8 (0.50) TLR4GJB2
SCHEMBL4199470 0.93 LGALS8 (0.50) TLR4GJB2
SCHEMBL4185394 0.93 LGALS8 (0.50) TLR4GJB2
SCHEMBL3388849 0.93 LGALS8 (0.50) TLR4GJB2
SCHEMBL4187653 0.91 FFAR1 (0.47) TLR4CETPSELP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2314351-B1 Hair dye agent with improved skin tolerance HENKEL AG & CO KGAA (DE) 2014-12-17 EP claimed
US-20230217875-A1 IN VITRO EMBRYO RESCUE BASF AGRICULTURAL SOLUTIONS US LLC 2023-07-13 US disclosed
EP-4161254-A1 IN VITRO EMBRYO RESCUE BASF Agricultural Solutions Seed US LLC (US) 2023-04-12 EP disclosed
WO-2022147470-A1 IMPROVED TOPICAL CANNABINOID COMPOSITIONS AND METHODS OF MAKING AND USING SAME KIMBERLY CLARK CO (US) 2022-07-07 WO disclosed
WO-2021251860-A1 IN VITRO EMBRYO RESCUE KOEHLER CLAUDIA (SE) 2021-12-16 WO disclosed
CN-101687167-B W/O/W type emulsified composition NISSHIN OILLIO GROUP LTD 2012-10-03 CN disclosed
US-7754864-B2 Tyrosinase activity controlling agent, process for producing the same and external preparation containing the same NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2010-07-13 US disclosed
US-20100099646-A1 W/O/W EMULSION COMPOSITION THE NISSHIN OILLIO GROUP, LTD. (JP) 2010-04-22 US disclosed
EP-2172263-A1 W/O/W EMULSION COMPOSITION The Nisshin OilliO Group, Ltd. (JP) 2010-04-07 EP disclosed
CN-101687167-A W/O/W type emulsified composition NISSHIN OILLIO GROUP LTD 2010-03-31 CN disclosed
US-20090098172-A1 SURFACTANT, AND EMULSION COSMETIC AND LIPOSOME EACH CONTAINING THE SAME KAO CORPORATION (JP) 2009-04-16 US disclosed
US-20070292462-A1 Surfactant, and an emulsion-type cosmetic composition and a liposome containing said surfactant KAO CORPORATION (JP) 2007-12-20 US disclosed
US-20070160556-A1 Surfactant, and an emulsion-type cosmetic composition and a liposome containing said surfactant IKEMOTO TAKESHI 2007-07-12 US disclosed
US-20060052318-A1 Tyrosinase activity cntrolling agent, process for producing the same and external preparations containing the same NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE (JP) 2006-03-09 US disclosed
EP-1550667-A1 TYROSINASE ACTIVITY CONTROLLING AGENTS, PROCESS FOR PRODUCING THE SAME AND EXTERNAL PREPARATIONS CONTAINING THE SAME National Institute of Advanced Industrial Science and Technology (JP) 2005-07-06 EP disclosed
US-20040022819-A1 Surfactant, and an emulsion-type cosmetic composition and a liposome containing said surfactant KAO CORPORATION (JP) 2004-02-05 US disclosed
US-6497898-B1 STABILITY, DRUG AND COSMETIC DELIVERY KANEBO LTD (JP) 2002-12-24 US disclosed
EP-0729781-B1 LIPOSOME COMPRISING A MEMBRANE WALL COMPOSED OF A TREHALOSE FATTY ACID ESTER KANEBO LTD (JP) 2002-08-07 EP disclosed
EP-0729781-A1 SURFACTANT, AND EMULSION COSMETIC AND LIPOSOME EACH CONTAINING THE SAME Ikemoto, Takeshi (JP) 1996-09-04 EP 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-20070292462-A1 Surfactant, and an emulsion-type cosmetic composition and a liposome containing said surfactant TREH, LIPA, CUTA TLR4 477/4885CETP 11/4885SELP 3602/4885
US-20060052318-A1 Tyrosinase activity cntrolling agent, process for producing the same and external preparations containing the same TYR, GAP43, CNTN1 TLR4 4809/4885CETP 2583/4885SELP 4181/4885
US-20040022819-A1 Surfactant, and an emulsion-type cosmetic composition and a liposome containing said surfactant TREH, LIPA, CUTA TLR4 451/4885CETP 16/4885SELP 3788/4885
US-20070160556-A1 Surfactant, and an emulsion-type cosmetic composition and a liposome containing said surfactant TREH, LIPA, CUTA TLR4 477/4885CETP 11/4885SELP 3602/4885
US-20090098172-A1 SURFACTANT, AND EMULSION COSMETIC AND LIPOSOME EACH CONTAINING THE SAME TREH, LIPA, SGMS1 TLR4 513/4885CETP 10/4885SELP 3517/4885

“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.