SCHEMBL4626068

SCHEMBL4626068

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

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 8/20 0.49
LY96 Q9Y6Y9 6/20 0.48
LGALS8 O00214 2/20 0.47
TK2 O00142 2/20 0.47

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
Heptane SCHEMBL8771598 1.00 TLR4 (0.49) TLR4LY96LGALS8TK2
SCHEMBL8822080 1.00 TLR4 (0.49) TLR4LY96LGALS8TK2
SCHEMBL8771563 1.00 TLR4 (0.49) TLR4LY96LGALS8TK2
SCHEMBL8822072 1.00 TLR4 (0.49) TLR4LY96LGALS8TK2
SCHEMBL9346790 1.00 TLR4 (0.49) TLR4LY96LGALS8TK2
SCHEMBL8195199 1.00 TLR4 (0.49) TLR4LY96LGALS8TK2
SCHEMBL9347504 1.00 TLR4 (0.49) TLR4LY96LGALS8TK2
SCHEMBL9342585 0.94 TLR4 (0.54) TLR4LY96TK2
SCHEMBL11504109 0.93 TLR4 (0.49) TLR4LY96TK2
SCHEMBL6269517 0.93 TLR4 (0.51) TLR4LY96

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3891102-B1 NANONETS FOR REMOVAL OF CONTAMINANTS FROM AQUEOUS SOLUTIONS, KITS THEREFOR AND METHODS OF THEIR USE CARBONET NANOTECHNOLOGIES INC (CA) 2024-04-17 EP disclosed
US-20230035776-A1 NANONETS FOR REMOVAL OF CONTAMINANTS FROM AQUEOUS SOLUTIONS, KITS THEREFOR AND METHODS OF THEIR USE CARBONET NANOTECHNOLOGIES INC. (CA) 2023-02-02 US disclosed
EP-3891102-A1 NANONETS FOR REMOVAL OF CONTAMINANTS FROM AQUEOUS SOLUTIONS, KITS THEREFOR AND METHODS OF THEIR USE Carbonet Nanotechnologies Inc. (CA) 2021-10-13 EP disclosed
WO-2020113330-A1 NANONETS FOR REMOVAL OF CONTAMINANTS FROM AQUEOUS SOLUTIONS, KITS THEREFOR AND METHODS OF THEIR USE CARBONET NANOTECHONOLOGIES INC. (CA) 2020-06-11 WO disclosed
EP-1605950-A4 NOVEL CHEMICAL ENTITIES AND METHODS FOR THEIR USE IN TREATMENT OF METABOLIC DISORDERS ACCERA INC (US) 2008-01-09 EP disclosed
WO-2006097348-A1 USE OF AGENTS SUCH AS NONPOLYMERIC NITRIC OXIDE DONORS FOR MAKING THE LIPS FULL AGAIN AND/OR COLOURING THE LIPS L'OREAL (FR) 2006-09-21 WO disclosed
US-20060189545-A1 Novel chemical entities and methods for their use in treatment of metabolic disorders ACCERA, INC. 2006-08-24 US disclosed
EP-1605950-A2 NOVEL CHEMICAL ENTITIES AND METHODS FOR THEIR USE IN TREATMENT OF METABOLIC DISORDERS Accera, Inc. (US) 2005-12-21 EP disclosed
WO-2004077938-A2 NOVEL CHEMICAL ENTITIES AND METHODS FOR THEIR USE IN TREATMENT OF METABOLIC DISORDERS ACCERA INC. (US) 2004-09-16 WO disclosed
EP-0566438-A1 Method for the preparation of D-maltose monoesters with a high 6-0'-ester content and their use in the cosmetic, dental-care, pharmaceuticals and food stuff fields L'OREAL (FR) 1993-10-20 EP disclosed
US-4150114-A ENHANCED PENETRATION THE PROCTER & GAMBLE COMPANY (US) 1979-04-17 US disclosed
US-4148893-A SUGAR ESTER AND DIALKYL SULFOXIDE ENHANCE PENETRATION THROUGH SKIN THE PROCTER & GAMBLE COMPANY (US) 1979-04-10 US disclosed
US-4148874-A ENHANCE PENETRATION OF PHARMOCOLOGICALLY ACTIVE AGENTS THROUGH THE SKIN THE PROCTER & GAMBLE COMPANY (US) 1979-04-10 US disclosed
US-4148917-A PENETRATION THE PROCTER & GAMBLE COMPANY (US) 1979-04-10 US disclosed
US-4148924-A Dermatological compositions THE PROCTER & GAMBLE COMPANY (US) 1979-04-10 US disclosed
US-4148887-A SUGAR ESTER WITH A METHYL SULFOXIDE THE PROCTER & GAMBLE COMPANY (US) 1979-04-10 US disclosed
US-4130667-A A SUCROSE ESTER AND A PHOSPHINE OXIDE THE PROCTER & GAMBLE COMPANY (US) 1978-12-19 US disclosed
US-4130643-A STEROID, SUCROSE ESTER, SULFOXIDE THE PROCTER & GAMBLE COMPANY (US) 1978-12-19 US disclosed
US-4046886-A SUGAR ESTER, PHOSPHINE OXIDE THE PROCTER & GAMBLE COMPANY (US) 1977-09-06 US disclosed
US-3952099-A MICROBIOCIDE, SUGAR ESTER, SULFOXIDE THE PROCTER & GAMBLE COMPANY (US) 1976-04-20 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 (1 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-20060189545-A1 Novel chemical entities and methods for their use in treatment of metabolic disorders BACE1, PC, PSEN2 TLR4 2655/4885LY96 3781/4885LGALS8 504/4885

“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.