SCHEMBL105901

SCHEMBL105901

CCCC(=O)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
SCHEMBL14929028 1.00
SCHEMBL28957089 0.91 CES2 (0.36)
SCHEMBL28312761 0.91 CYP1A2 (0.38)
SCHEMBL106298 0.84 CES2 (0.48)
SCHEMBL19973390 0.84 CES2 (0.48)
SCHEMBL3409269 0.82 CES2 (0.56)
SCHEMBL2532287 0.81
SCHEMBL269738 0.81 CES2 (0.41)
SCHEMBL2532284 0.81
SCHEMBL20838327 0.80 CES2 (0.59)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260018256-A1 AN ODOR PREDICTION METHOD FOR AQUEOUS POLYMER COMPOSITION DOW GLOBAL TECHNOLOGIES LLC (US) 2026-01-15 US 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-2025150071-A1 A TERNARY INSECTICIDAL COMPOSITION FOR INSECTS, PESTS AND MITES RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) 2025-07-17 WO claimed
WO-2025109628-A1 A SYNERGISTIC TERNARY INSECTICIDAL COMPOSITION RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) 2025-05-30 WO claimed
EP-4551937-A1 AN ODOR PREDICTION METHOD FOR AQUEOUS POLYMER COMPOSITION Dow Global Technologies LLC (US) 2025-05-14 EP claimed
US-20250075147-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING NEW FLAVOR AND FRAGRANCE INGREDIENTS OSMO LABS, PBC 2025-03-06 US claimed
CN-119546957-A Odor prediction method for aqueous polymer composition 陶氏环球技术有限责任公司 2025-02-28 CN claimed
US-20240261353-A1 BIOACTIVE CONCENTRATES AND USES THEREOF Purple Mondo, Inc. 2024-08-08 US claimed
EP-2999344-B1 METHODS FOR ATTRACTING AND STIMULATING FEEDING BY MICE AND RATS SCOTTS CANADA LTD (CA) 2024-04-17 EP claimed
WO-2024026672-A1 AN ODOR PREDICTION METHOD FOR AQUEOUS POLYMER COMPOSITION DOW GLOBAL TECHNOLOGIES LLC (US) 2024-02-08 WO claimed
US-20050282878-A1 Process for the purification of fluconazole GLENMARK PHARMACEUTICALS LIMITED (IN) 2005-12-22 US claimed
US-6706216-B1 REACTION PRODUCT OF CATALYTIC REDUCTIVE ALKYLATION OF P-PHENYLENEDIAMINE OR DERIVATIVE WITH ACETONE AND SECOND CARBONYL COMPOUND UNIROYAL CHEMICAL COMPANY, INC. 2004-03-16 US claimed
US-6706217-B2 OBTAINED FROM THE REACTION OF A PARAPHENYLENEDIAMINE COMPOUND WITH ACETONE AND AT LEAST ONE OF KETONES AND ALDEHYDES, USING A REDUCTIVE ALKYLATION CATALYST UNIROYAL CHEMICAL COMPANY, INC. 2004-03-16 US claimed
US-20040019238-A1 Preparation of secondary amines HUNTSMAN PETROCHEMICAL CORPORATION 2004-01-29 US claimed
US-20040015016-A1 Preparation of secondary amines HUNTSMAN PETROCHEMICAL CORPORATION 2004-01-22 US claimed
EP-1276804-A1 LIQUID ANTIOZONANTS AND RUBBER COMPOSITIONS CONTAINING SAME Uniroyal Chemical Company, Inc. (US) 2003-01-22 EP claimed
US-20020061946-A1 Liquid antiozonants and rubber compositions containing same ADDIVANT USA, LLC 2002-05-23 US claimed
WO-2001081459-A1 LIQUID ANTIOZONANTS AND RUBBER COMPOSITIONS CONTAINING SAME UNIROYAL CHEMICAL COMPANY, INC. (US) 2001-11-01 WO claimed
US-5661199-A PREVENTION OF PRELIMINARY CROSSLINKING; STABILIZER FUNCTIONS AS FILM-FORMING AGENT HERBERTS GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1997-08-26 US claimed
US-5331086-A Deashing process for polyolefins using an alpha,beta-unsaturated ketone PHILLIPS PETROLEUM COMPANY (US) 1994-07-19 US claimed