SCHEMBL5801039

SCHEMBL5801039

CCC(C(C)=O)C(C)C

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
SCHEMBL14321426 0.81 TSHR (0.36)
SCHEMBL13106821 0.80
SCHEMBL25846981 0.80 CA1 (0.36)
SCHEMBL6722188 0.80
SCHEMBL8061239 0.80 CA1 (0.36)
SCHEMBL368314 0.79 SLC1A3 (0.37)
SCHEMBL23531324 0.78
SCHEMBL17037482 0.78 TDP1 (0.40)
SCHEMBL28304012 0.78
SCHEMBL12880105 0.78 TDP1 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
CN-102459499-A Azeotropic and azeotrope-like compositions of Z-1,1,1,4,4, 4-hexafluoro-2-butene, trans-1, 2-dichloroethylene and a third component DU PONT 2012-05-16 CN claimed
WO-2025217491-A1 STABLE SOLUBLE LIQUID FORMULATION FOR INSECTICIDE CORTEVA AGRISCIENCE LLC (US) 2025-10-16 WO disclosed
WO-2025150071-A1 A TERNARY INSECTICIDAL COMPOSITION FOR INSECTS, PESTS AND MITES RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) 2025-07-17 WO disclosed
WO-2025128788-A1 STINK BUG CONTROL COMPOSITION AND METHOD CORTEVA AGRISCIENCE LLC (US) 2025-06-19 WO disclosed
WO-2025109628-A1 A SYNERGISTIC TERNARY INSECTICIDAL COMPOSITION RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) 2025-05-30 WO disclosed
WO-2025094188-A1 A SYNERGISTIC INSECTICIDAL COMPOSITION RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) 2025-05-08 WO disclosed
CN-119403907-A Fragrance composition and product for delivering positive emotion 西姆莱斯有限公司 2025-02-07 CN disclosed
US-20230292753-A1 AN INSECTICIDAL COMPOSITION FOR PEST CONTROL COMPRISING OF DIACYLHYDRAZINES RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) 2023-09-21 US disclosed
US-20230284619-A1 Agrochemical mixtures of diamides, plant health additives and insecticide RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) 2023-09-14 US disclosed
EP-0777658-A1 SUBSTITUTED TRIAZOLINONES AS PLANT PROTECTIVE AGENTS BASF AKTIENGESELLSCHAFT (DE) 1997-06-11 EP disclosed
US-5602074-A HERBICIDES; PLANT DESICCATION, DEFOLIATION BASF AKTIENGESELLSCHAFT (DE) 1997-02-11 US disclosed
WO-1996005179-A1 SUBSTITUTED TRIAZOLINONES AS PLANT PROTECTIVE AGENTS BASF AKTIENGESELLSCHAFT (DE) 1996-02-22 WO disclosed
EP-0641321-A1 SUBSTITUTED ISOINDOLONES BASF Aktiengesellschaft (DE) 1995-03-08 EP disclosed
CN-1027449-C aqueous coating composition, and use thereof BASF LACKE & FARBEN (DE) 1995-01-18 CN disclosed
WO-1993024456-A1 SUBSTITUTED ISOINDOLONES BASF AKTIENGESELLSCHAFT (DE) 1993-12-09 WO disclosed
WO-1993022280-A1 SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM BASF AKTIENGESELLSCHAFT (DE) 1993-11-11 WO disclosed
CN-1049509-A The method of coating electrically conductive substrates, aqueous coating composition contains the preparation method of urethane ester group adducts and contains the adducts of urethane ester group BASF LACKE & FARBEN (DE) 1991-02-27 CN disclosed
US-3996113-A SEPARATION OF C4 AND C5 HYDROCARBONS PETRO-TEX CHEMICAL CORPORATION (US) 1976-12-07 US disclosed