SCHEMBL1781510

SCHEMBL1781510

CCC(C)C=C(C)C=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
SCHEMBL1781509 1.00
SCHEMBL1189179 0.81 PTPN1 (0.36)
SCHEMBL1189177 0.81 PTPN1 (0.36)
SCHEMBL7044316 0.80
SCHEMBL7044317 0.80
SCHEMBL4215698 0.78 PTPN1 (0.37)
SCHEMBL4215701 0.78 PTPN1 (0.37)
SCHEMBL1785032 0.78 TSHR (0.39)
SCHEMBL1785030 0.78 TSHR (0.39)
SCHEMBL23412209 0.77 PTPN1 (0.39)

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
EP-4065566-B1 TRPM8 MODULATORS GIVAUDAN SA (CH) 2025-01-01 EP disclosed
CN-114761385-B TRPM8 modulators 奇华顿股份有限公司 2024-10-29 CN disclosed
US-20230002334-A1 TRPM8 MODULATORS GIVAUDAN SA (CH) 2023-01-05 US disclosed
EP-4065566-A1 TRPM8 MODULATORS Givaudan SA (CH) 2022-10-05 EP disclosed
CN-114761385-A TRPM8 modulators 奇华顿股份有限公司 2022-07-15 CN disclosed
WO-2021105261-A1 TRPM8 MODULATORS GIVAUDAN SA (CH) 2021-06-03 WO disclosed
US-20190241822-A1 COMPOSITION FOR REMOVING IRON SULFIDE KURARAY CO., LTD. (JP) 2019-08-08 US disclosed
EP-3486353-A1 COMPOSITION FOR REMOVING IRON SULFIDE Kuraray Co., Ltd. (JP) 2019-05-22 EP disclosed
CN-109415819-A For removing the composition of iron sulfide 株式会社可乐丽 2019-03-01 CN disclosed
US-8632792-B2 Cooling sensation agent composition and sensory stimulation agent composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-01-21 US disclosed
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-05-19 US disclosed
WO-2009123355-A2 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-10-08 WO disclosed