SCHEMBL107778

SCHEMBL107778

CC(C)CCC=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
Ethane SCHEMBL3782667 0.97
SCHEMBL28765622 0.97
Water SCHEMBL27077266 0.97 ALDH1A1 (0.40)
SCHEMBL1010069 0.97
SCHEMBL7844269 0.97
Methane SCHEMBL782703 0.97
SCHEMBL29190497 0.97
Acetone SCHEMBL6251480 0.89 CA1 (0.39)
SCHEMBL19638210 0.89 ALDH1A1 (0.35)
SCHEMBL1784683 0.83 LMNA (0.38)

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

Appears in 6139 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4680020-A1 COMPOSITIONS INCLUDING ALDEHYDES WITH IMPROVED RELEASE RATE AND DEGRADATION PROPERTIES FMC Agricultural Solutions A/S (DK) 2026-01-21 EP claimed
US-12509598-B2 Process solution composition for polymer treatment comprising a fluorine compound, a ketone solvent, and a polar aprotic solvent DONGWOO FINE-CHEM CO., LTD. (KR) 2025-12-30 US claimed
WO-2025228975-A1 PARTICLES, COMPOSITIONS AND METHODS BioNTech SE (DE) 2025-11-06 WO claimed
EP-4624043-A1 HYDROGENATION CATALYST Hanwha Solutions Corporation (KR) 2025-10-01 EP claimed
WO-2025093665-A1 PARTICLES, COMPOSITIONS AND METHODS BioNTech SE (DE) 2025-05-08 WO claimed
CN-119229952-B Identification model construction system, storage medium and kit for metabolism unhealthy obesity 上海交通大学医学院附属仁济医院 2025-02-18 CN claimed
CN-119229952-A Identification model construction system, storage medium and kit for metabolism unhealthy obesity 上海交通大学医学院附属仁济医院 2024-12-31 CN claimed
CN-118908158-A Solvent-free synthesis method of lithium bis (fluorosulfonyl) imide liquid salt and solid salt thereof 兰州康鹏新能源科技有限公司 2024-11-08 CN claimed
WO-2024189207-A1 COMPOSITIONS INCLUDING ALDEHYDES WITH IMPROVED RELEASE RATE AND DEGRADATION PROPERTIES FMC Agricultural Solutions A/S (DK) 2024-09-19 WO claimed
WO-2024144329-A1 HYDROGENATION CATALYST 한화솔루션 주식회사 2024-07-04 WO claimed
EP-0411332-A1 Antiviral peptides having a 2-oxoalkyl amino acid side chain BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1991-02-06 EP claimed
EP-0411334-A1 Antiherpes pentapeptide derivatives having a substituted aspartic acid side chain BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1991-02-06 EP claimed
WO-1990005141-A1 AMINO ACID AND PEPTIDE INHIBITORS OF HUMAN LEUKOCYTIC ELASTASE AND COLLAGENASE AUSTRALIAN COMMERCIAL RESEARCH & DEVELOPMENT LIMITED (AU) 1990-05-17 WO claimed
US-4911745-A Containing a phenyl substituted in position 3 of ring ICI AMERICAS INC. (US) 1990-03-27 US claimed
US-4857507-A HYPOTENSIVE AGENT ABBOTT LABORATORIES (US) 1989-08-15 US claimed
US-4853252-A Method and coating material for applying electrically conductive printed patterns to insulating substrates SIEMENS AKTIENGESELLSCHAFT (DE) 1989-08-01 US claimed
US-4794129-A POLYUREAS FROM POLYISOCYANATES AND IMINO FUNCTIONAL COMPOUND ICI AMERICAS INC. (US) 1988-12-27 US claimed
EP-0191542-B1 ARYLCYCLOBUTYLALKYL AMINES AND THEIR USE AS ANTIDEPRESSIVE MEDICINES The Boots Company PLC (GB) 1988-06-08 EP claimed
EP-0241787-A1 2,5-Substituted dihydroresorcinol ether derivatives BASF Aktiengesellschaft (DE) 1987-10-21 EP claimed
US-4070366-A RING ALKYLATION OF SUBSTITUTED PYRROLES, ONE STEP CANADIAN PATENTS & DEVELOPMENT LIMITED (US) 1978-01-24 US claimed