SCHEMBL97285

SCHEMBL97285

CCC=CCCOC=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
SCHEMBL1692338 1.00
SCHEMBL272927 1.00
SCHEMBL1872323 1.00 LPAR2 (0.38)
SCHEMBL11801564 0.86 LPAR3 (0.44)
SCHEMBL25713169 0.86 LPAR3 (0.44)
SCHEMBL29010514 0.86 LPAR3 (0.44)
SCHEMBL7483919 0.85 ALDH1A1 (0.39)
SCHEMBL30853563 0.84 ALDH1A1 (0.61)
SCHEMBL3035572 0.82 LPAR2 (0.55)
SCHEMBL3031134 0.82 LPAR2 (0.55)

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 1513 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12568998-B2 Flavouring composition with balanced taste profile SYMRISE AG (DE) 2026-03-10 US claimed
EP-4302747-B1 SYSTEM FOR DISPENSING A COSMETIC PRODUCT OREAL (FR) 2026-01-14 EP claimed
US-20250212873-A1 VOLATILE HDAC INHIBITORS FOR THERAPEUTIC AND PLANT APPLICATIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-07-03 US claimed
EP-4565194-A1 ODOR AND COLORANT STABILIZED COMPOSITIONS Symrise AG (DE) 2025-06-11 EP claimed
US-20250163006-A1 New Coolants, and Preparations Containing Same SYMRISE AG (DE) 2025-05-22 US claimed
CN-119924491-A Flavoring composition with balanced taste characteristics 西姆莱斯有限公司 2025-05-06 CN claimed
CN-119744164-A Odor and colorant stable compositions 西姆莱斯股份公司 2025-04-01 CN claimed
US-12239209-B2 System for dispensing a cosmetic product L'OREAL (FR) 2025-03-04 US claimed
WO-2025026525-A1 HETEROCYCLIC COMPOUNDS AS PHYSIOLOGICAL COOLANTS SYMRISE AG (DE) 2025-02-06 WO claimed
US-12187978-B2 Use of (3-acetoxy-2,2-dimethyl-propyl) acetate in combination with (3-hydroxy-2,2-dimethyl-propyl) acetate as an aroma chemical BASF SE (DE) 2025-01-07 US claimed
US-20120107477-A1 THERMALLY STABLE HIGH IMPACT FLAVORING PARTICLES SYMRISE AG (DE) 2012-05-03 US claimed
WO-2011147455-A1 FLAVORING SUBSTANCE-INCLUDED COMPOUNDS SYMRISE AG (DE) 2011-12-01 WO claimed
US-8034761-B2 Jasmone, peach fragrance SYMRISE AG (DE) 2011-10-11 US claimed
WO-2011075556-A1 COMPOSITION COMPRISING ENCAPSULATES, AND PROCESS FOR MAKING THEM THE PROCTER & GAMBLE COMPANY (US) 2011-06-23 WO claimed
US-4335002-A FLAVORINGS, PERFUMES INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-06-15 US claimed
US-4319586-A Uses of hexenol derivatives in augementing or enhancing the aroma or taste of smoking tobacco compositions and smoking tobacco articles INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-03-16 US claimed
US-4312766-A ENHANCING AROMA OF DRIER ADDED FABRIC SOFTENER ARTICLE INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-01-26 US claimed
US-4280933-A USING PYRIDINE CHLOROCHROMATE AS AN OXIDIZING AGENT INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1981-07-28 US claimed
US-4267066-A Process for augmenting or enhancing the aroma of detergent using derivatives of cis-3-hexenol INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1981-05-12 US claimed
US-4241098-A Flavoring with a mixture of cis-3-hexenal, trans-2-hexenal, cis-3-hexenyl formate, cis-3-hexenol and cis-3-hexenyl-cis-3-hexenoate INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1980-12-23 US claimed