SCHEMBL4065413

SCHEMBL4065413

CC(C)C1(C)CCCC(OCCC(O)O)C1

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
SCHEMBL12076421 0.87
SCHEMBL248360 0.84
SCHEMBL301735 0.83
SCHEMBL290834 0.82
SCHEMBL6353996 0.82
SCHEMBL7666136 0.81 MEN1 (0.30)
SCHEMBL4054354 0.81 LTB4R (0.30)
SCHEMBL6009698 0.81
SCHEMBL906647 0.81
SCHEMBL2350231 0.80 EPHX2 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070190090-A1 SIALAGOGUE BASED ORAL CARE PRODUCTS WHITEHILL ORAL TECHNOLOGIES, INC. (US) 2007-08-16 US claimed
US-20060177384-A1 Sialagogue coatings for interproximal devices WHITEHILL ORAL TECHNOLOGIES, INC. 2006-08-10 US claimed
US-12378500-B2 Liquid laundry product comprising a fragrance composition comprising isopulegol TAKASAGO INTERNATIONAL CORPORATION (JP) 2025-08-05 US disclosed
EP-3388508-B1 LAUNDRY PRODUCT TAKASAGO PERFUMERY CO LTD (JP) 2023-08-02 EP disclosed
US-20210301219-A1 STIMULATING AGENT TAKASAGO INTERNATIONAL CORPORATION (JP) 2021-09-30 US disclosed
EP-3211064-B1 STIMULATING AGENT TAKASAGO PERFUMERY CO LTD (JP) 2020-11-11 EP disclosed
EP-2356958-B1 HEAT GENERATING DEVICE KAO CORP (JP) 2019-05-15 EP disclosed
EP-3395933-A1 PERSONAL CARE PRODUCT Takasago International Corporation (JP) 2018-10-31 EP disclosed
EP-3388508-A1 LAUNDRY PRODUCT Takasago International Corporation (JP) 2018-10-17 EP disclosed
WO-2017146183-A1 STIMULATING AGENT TAKASAGO INTERNATIONAL CORPORATION (JP) 2017-08-31 WO disclosed
EP-3211064-A1 STIMULATING AGENT Takasago International Corporation (JP) 2017-08-30 EP disclosed
US-8945072-B2 Heat generating device KAO CORPORATION (JP) 2015-02-03 US disclosed
US-8632792-B2 Cooling sensation agent composition and sensory stimulation agent composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-01-21 US disclosed
US-20130131169-A1 COOLING SENSATION AGENT COMPOSITION, SENSORY STIMULATION AGENT COMPOSITION AND USE OF THE SAME TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-05-23 US disclosed
WO-2009123355-A2 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-10-08 WO disclosed
US-5753609-A Fragrance composition containing 4-(1-menthoxymethyl)-2-phenyl-1,3-dioxolane or its derivatives TAKASAGO INTERNATIONAL CORPORATION (JP) 1998-05-19 US disclosed
US-5545424-A 4-(1-menthoxymethyl)-2-phenyl-1,3-dioxolane or its derivatives and flavor composition containing the same TAKASAGO INTERNATIONAL CORPORATION (JP) 1996-08-13 US disclosed