SCHEMBL6135565

SCHEMBL6135565

CCN(C)C(C)C(=O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL11997982 1.00
SCHEMBL18980132 1.00
SCHEMBL12301657 0.82 KCNH2 (0.31)
SCHEMBL14300995 0.82 KCNH2 (0.31)
SCHEMBL18909422 0.80 HTR2A (0.37)
SCHEMBL19488728 0.80 HTR2A (0.37)
SCHEMBL11878714 0.80 HTR2A (0.37)
SCHEMBL7766013 0.79
SCHEMBL14577480 0.77 CA1 (0.39)
SCHEMBL27702123 0.77

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539128-A2 USE OF SKIN-PROTECTING SUBSTANCES Phenion GmbH &amp; Co KG (DE) 2005-06-15 EP claimed
WO-2004026295-A9 USE OF SKIN-PROTECTING SUBSTANCES PHENION GMBH & CO KG (DE) 2004-09-16 WO claimed
WO-2004026295-A2 USE OF SKIN-PROTECTING SUBSTANCES PHENION GMBH & CO. KG (DE) 2004-04-01 WO claimed
US-20250059157-A1 TLR7/8 ANTAGONISTS AND USES THEREOF MERCK PATENT GMBH (DE) 2025-02-20 US disclosed
US-20230303514-A1 TLR7/8 ANTAGONISTS AND USES THEREOF MERCK PATENT GMBH (DE) 2023-09-28 US disclosed
CN-112574061-B TRPV1 agonist and preparation method and application thereof 南京清普生物科技有限公司 2023-05-19 CN disclosed
US-11629134-B2 TLR7/8 antagonists and uses thereof MERCK PATENT GMBH (DE) 2023-04-18 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
CN-115103907-A Compositions and methods for enhancing immune activity 金橘生物科技公司 2022-09-23 CN disclosed
CN-108699032-B Polycyclic TLR7/8 antagonists and their use in the treatment of immune disorders 默克专利有限公司 2022-07-22 CN disclosed
CN-113603675-A Polycyclic TLR7/8 antagonists and their use in the treatment of immune disorders 默克专利有限公司 2021-11-05 CN disclosed
WO-2017106607-A1 POLYCYCLIC TLR7/8 ANTAGONISTS AND USE THEREOF IN THE TREATMENT OF IMMUNE DISORDERS MERCK PATENT GMBH (DE) 2017-06-22 WO disclosed
WO-2016081522-A1 NANOMATERIAL COMPOSITIONS, SYNTHESIS, AND ASSEMBLY RHODE ISLAND HOSPITAL (US) 2016-05-26 WO disclosed
US-20110059940-A1 2-Aryl Glycinamide Derivatives BRISTOL- MYERS SQUIBB COMPANY 2011-03-10 US disclosed
EP-1423382-B1 PYRAZOLE-DERIVED KINASE INHIBITORS AND USES THEREOF VERTEX PHARMA (US) 2008-04-16 EP disclosed
EP-1539128-A2 USE OF SKIN-PROTECTING SUBSTANCES Phenion GmbH &amp; Co KG (DE) 2005-06-15 EP disclosed
WO-2004026295-A9 USE OF SKIN-PROTECTING SUBSTANCES PHENION GMBH & CO KG (DE) 2004-09-16 WO disclosed
WO-2004026295-A2 USE OF SKIN-PROTECTING SUBSTANCES PHENION GMBH & CO. KG (DE) 2004-04-01 WO disclosed
EP-0877018-B1 Sulfonylaminocarboxylic acids AVENTIS PHARMA GMBH (DE) 2003-05-02 EP disclosed
US-4145432-A 6-ACYLORYALKYL-1,4-DIHYDROPYRIDINE DERIVATIVES AND A METHOD OF EFFECTING VASODILATION THEREWITH FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1979-03-20 US disclosed