SCHEMBL3387971

SCHEMBL3387971

[CH2]C/C=C\C/C=C\CC

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
SCHEMBL4969578 1.00 ALDH1A1 (0.41)
SCHEMBL1611678 1.00 ALDH1A1 (0.41)
SCHEMBL1551787 1.00 ALDH1A1 (0.41)
SCHEMBL17798928 1.00 ALDH1A1 (0.41)
SCHEMBL10910041 1.00
SCHEMBL21679678 1.00 ALDH1A1 (0.41)
SCHEMBL21679677 1.00 ALDH1A1 (0.41)
SCHEMBL21484057 1.00 ALDH1A1 (0.41)
SCHEMBL21484058 1.00 ALDH1A1 (0.41)
SCHEMBL1611679 1.00 ALDH1A1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240140902-A1 NOVEL METHOD FOR MANUFACTURING TOMATO LEAFMINER PHEROMONE COMPONENTS MELCHIOR MATERIAL AND LIFE SCIENCE FRANCE (FR) 2024-05-02 US disclosed
EP-4291169-A1 NOVEL METHOD FOR MANUFACTURING TOMATO LEAFMINER PHEROMONE COMPONENTS Melchior Material And Life Science France (FR) 2023-12-20 EP disclosed
WO-2023044460-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING HYDROXYMELONAL FORMATE ESTER P2 SCIENCE, INC. (US) 2023-03-23 WO disclosed
US-10907116-B2 Olfactive compositions comprising cyclohexyl-alkyl carbinols P2 SCIENCE, INC. (US) 2021-02-02 US disclosed
EP-3247691-B1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING NEOPENTYL GLYCOL DIACETATE P2 SCIENCE INC (US) 2020-09-16 EP disclosed
EP-3414309-A1 FRAGRANCE COMPOSITIONS COMPRISING COMPOUNDS WITH OLFACTORY QUALITIES P2 Science, Inc. (US) 2018-12-19 EP disclosed
US-20180346844-A1 FRAGRANCE COMPOSITIONS COMPRISING COMPOUNDS WITH OLFACTORY QUALITIES P2 SCIENCE, INC. 2018-12-06 US disclosed
US-10072233-B2 Fragrance and flavor compositions comprising neopentyl glycol diacetate P2 SCIENCE, INC. (US) 2018-09-11 US disclosed
US-20180163158-A1 OLFACTIVE COMPOSITIONS COMPRISING CYCLOHEXYL-ALKYL CARBINOLS P2 SCIENCE, INC. 2018-06-14 US disclosed
EP-3303534-A1 OLFACTIVE COMPOSITIONS COMPRISING CYCLOHEXYL-ALKYL CARBINOLS P2 Science, Inc. (US) 2018-04-11 EP disclosed
WO-2016197000-A1 OLFACTIVE COMPOSITIONS COMPRISING CYCLOHEXYL-ALKYL CARBINOLS P2 SCIENCE, INC. (US) 2016-12-08 WO disclosed
WO-2016118882-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING NEOPENTYL GLYCOL DIACETATE cP2 SCIENCE, INC. (US) 2016-07-28 WO disclosed
US-20140162932-A1 AQUEOUS LIQUID FRAGRANCE COMPOSITION AND AQUEOUS LIQUID FRAGRANCE USING SAME TAKASAGO INTERNATIONAL CORPORATION 2014-06-12 US disclosed
US-8333957-B2 Liquid deodorant composition and deodorizing method TAKASAGO INTERNATIONAL CORPORATION (JP) 2012-12-18 US disclosed
US-20100074971-A1 DOUBLE PREPARATION TYPE ANTIOXIDANT COMPOSITION AND ANTIOXIDATION PRODUCT COMPRISING THE SAME TAKASAGO INTERNATIONAL CORPORATION (JP) 2010-03-25 US disclosed
US-20090092571-A1 LIQUID DEODORANT COMPOSITION AND DEODORIZING METHOD TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-04-09 US disclosed
EP-2042198-A1 LIQUID DEODORANT COMPOSITION AND METHOD OF DEODORIZING Takasago International Corporation (JP) 2009-04-01 EP disclosed
EP-0419330-B1 Method for the preparation of an alkynyl compound SHINETSU CHEMICAL CO (JP) 1994-06-01 EP disclosed
US-5082961-A METHOD FOR THE PREPARATION OF AN ALKYNYL COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 1992-01-21 US disclosed
EP-0419330-A2 Method for the preparation of an alkynyl compound Shin-Etsu Chemical Co., Ltd. (JP) 1991-03-27 EP disclosed