SCHEMBL1686949

SCHEMBL1686949

C=CC(=O)C=CCCC

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
SCHEMBL1686947 1.00
SCHEMBL22729265 0.96 TAS1R3 (0.40)
SCHEMBL22729264 0.96 TAS1R3 (0.40)
SCHEMBL17294082 0.86 TSHR (0.48)
SCHEMBL17294081 0.86 TSHR (0.48)
SCHEMBL9069564 0.85 TAS1R3 (0.48)
SCHEMBL2128303 0.85 TAS1R3 (0.48)
SCHEMBL5925126 0.85 PPARG (0.49)
SCHEMBL23093949 0.83 TSHR (0.52)
SCHEMBL13452505 0.83 TSHR (0.52)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6623774-B2 Treating with silica and vacuum steam deordorizing in the presence of rosemary or sage extract ROCHE VITAMINS INC. 2003-09-23 US claimed
CN-119769703-A Method for producing low-salt high-quality fish gravy by fermenting dark meat of tuna with yellow fins 海南大学 2025-04-08 CN disclosed
CN-113527141-B Synthetic method of spiro [2,5] octane derivative 江西省科学院应用化学研究所 2023-04-14 CN disclosed
CN-113527141-A Synthetic method of spiro [2,5] octane derivative 江西省科学院应用化学研究所 2021-10-22 CN disclosed
EP-2111765-B1 Hoodia plant extract with improved flavor UNILEVER NV (NL) 2013-01-16 EP disclosed
US-7923435-B2 Hoodia plant extract with improved flavor PHYTOPHARM PLC (GB) 2011-04-12 US disclosed
EP-2111763-A1 Process of making hoodia plant extract with improved flavor UNILEVER N.V. (NL) 2009-10-28 EP disclosed
EP-2111765-A1 Hoodia plant extract with improved flavor UNILEVER N.V. (NL) 2009-10-28 EP disclosed
US-20090264376-A1 Hoodia plant extract with improved flavor CONOPCO, INC., D/B/A UNILEVER 2009-10-22 US disclosed
US-20090263510-A1 Process of making Hoodia plant extract with improved flavor CONOPCO, INC., D/B/A UNILEVER 2009-10-22 US disclosed
US-6623774-B2 Treating with silica and vacuum steam deordorizing in the presence of rosemary or sage extract ROCHE VITAMINS INC. 2003-09-23 US disclosed
CN-1125934-A Process for preparing phenethanol ethers HOECHST CELANESE CORP (US) 1996-07-03 CN disclosed
US-5124489-A Process for preparing phenethanol ethers by the reduction of corresponding phenylglyoxal acetals HOECHST CELANESE CORPORATION (US) 1992-06-23 US disclosed
US-4198532-A 2,5,7-TIRMETHYL-OCTAN-3-OL OR 6,8-DIMETHYL-NONAN-2-OL GIVAUDAN CORPORATION (US) 1980-04-15 US disclosed