SCHEMBL11117501

SCHEMBL11117501

COC(=O)OC1C(C=O)C1(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
SCHEMBL11122492 1.00
SCHEMBL11444262 0.83
SCHEMBL11200456 0.83 TSHR (0.31)
SCHEMBL11291355 0.79
SCHEMBL11203457 0.79 ALDH1A1 (0.41)
SCHEMBL10782221 0.79
SCHEMBL10754289 0.79
SCHEMBL11207118 0.79
SCHEMBL10864195 0.79
SCHEMBL11379132 0.78 ALDH1A1 (0.32)

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0019787-B1 2-PHENYLALKEN-1-YL-CYCLOPROPANE-CARBOXYLIC ACID ESTERS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS INSECTICIDES AND ACARICIDES; INTERMEDIATES IN THEIR PREPARATION BAYER AG (DE) 1984-03-14 EP disclosed
EP-0035754-B1 PROCESS FOR MANUFACTURING 1,1-DICHLORO-ALKENES BAYER AG (DE) 1983-08-24 EP disclosed
EP-0035753-B1 PROCESS FOR MANUFACTURING 1,1-DICHLORO-ALKENES BAYER AG (DE) 1983-06-22 EP disclosed
EP-0019090-B1 SUBSTITUTED STYRYL-CYCLOPROPANECARBOXYLIC ACID DERIVATIVES, A PROCESS FOR THEIR PRODUCTION, THEIR USE, INSECTICIDAL AND ACARICIDAL COMPOSITIONS, THEIR PRODUCTION AND PROCESS FOR COMBATING INSECTS BAYER AG (DE) 1983-05-18 EP disclosed
EP-0035724-B1 PROCESS FOR MANUFACTURING 1,1-DIHALOGENATED ALKENES BAYER AG (DE) 1983-05-18 EP disclosed
EP-0006205-B1 PROCESS FOR THE PREPARATION OF CHLOROSTYRENECYCLOPROPANE CARBOXYLIC ACID DERIVATIVES BAYER AG (DE) 1982-09-22 EP disclosed
EP-0035754-A2 Process for manufacturing 1,1-dichloro-alkenes BAYER AG (DE) 1981-09-16 EP disclosed
EP-0035724-A2 Process for manufacturing 1,1-dihalogenated alkenes BAYER AG (DE) 1981-09-16 EP disclosed
EP-0035753-A2 Process for manufacturing 1,1-dichloro-alkenes BAYER AG (DE) 1981-09-16 EP disclosed
EP-0022971-A1 Process for the preparation of 3-(2,2-dichlorovinyl)-2,2-dimethyl-cyclopropane-1-carboxylic acid derivatives BAYER AG (DE) 1981-01-28 EP disclosed
EP-0019787-A2 2-Phenylalken-1-yl-cyclopropane-carboxylic acid esters, process for their preparation and their use as insecticides and acaricides; intermediates in their preparation BAYER AG (DE) 1980-12-10 EP disclosed
EP-0019090-A1 Substituted styryl-cyclopropanecarboxylic acid derivatives, a process for their production, their use, insecticidal and acaricidal compositions, their production and process for combating insects BAYER AG (DE) 1980-11-26 EP disclosed
EP-0006205-A1 Process for the preparation of chlorostyrenecyclopropane carboxylic acid derivatives BAYER AG (DE) 1980-01-09 EP disclosed