SCHEMBL5014866

SCHEMBL5014866

CC(C)C1(C)CCCC(OC(O)CCO)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
SCHEMBL612217 0.87
SCHEMBL15416508 0.80
SCHEMBL6562830 0.80
SCHEMBL5164194 0.80 MEN1 (0.32)
SCHEMBL5164192 0.79
SCHEMBL1784213 0.78 L3MBTL1 (0.30)
SCHEMBL1133724 0.78
SCHEMBL248360 0.77
SCHEMBL2363464 0.77 MEN1 (0.33)
SCHEMBL375499 0.77 MEN1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080112910-A1 Cool feeling composition, cool feeling auxiliary composition, and use thereof ISHIDA KENYA 2008-05-15 US disclosed
EP-1496095-B1 REFRIGERANT COMPOSITIONS AND USES THEREOF TAKASAGO PERFUMERY CO LTD (JP) 2006-12-20 EP disclosed
US-20050129721-A1 Refrigerant composition, refrigerant auxiliary compositions and uses thereof TAKASAGO INTERNATIONAL CORPORATION (JP) 2005-06-16 US disclosed
EP-1496095-A1 REFRIGERANT COMPOSITIONS, REFRIGERANT AUXILIARY COMPOSITIONS AND USES THEREOF Takasago International Corporation (JP) 2005-01-12 EP 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