SCHEMBL3381497

SCHEMBL3381497

CC1(C)C(CC(Cl)(Cl)Cl)C1C(=O)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
SCHEMBL11376575 1.00
SCHEMBL11142910 1.00
SCHEMBL11142915 1.00
SCHEMBL10683377 1.00
Hydrochloric Acid SCHEMBL10491392 0.98
Hydrochloric Acid SCHEMBL10491386 0.98
SCHEMBL11143570 0.86
SCHEMBL11143565 0.86
SCHEMBL10979030 0.86
SCHEMBL3381485 0.86

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4855446-A Process for the resolution of racemates using lactone esters THE SHERWIN WILLIAMS COMPANY (US) 1989-08-08 US claimed
US-4740612-A Process for production of β-dihalogenoethenylcyclopropane derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-04-26 US claimed
EP-0060445-B1 PROCESS FOR THE RESOLUTION OF RACEMATES AND LACTONE ESTERS USED IN SAID PROCESS F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1984-08-01 EP claimed
US-4390547-A 2,2-Dimethyl-3-(substituted ethyl)cyclopropane carboxylate pesticidal compositions and methods KURARAY CO., LTD. (JP) 1983-06-28 US claimed
EP-0060445-A1 Process for the resolution of racemates and lactone esters used in said process F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1982-09-22 EP claimed
JP-55083704-A None JP disclosed
JP-52095638-A None JP disclosed
EP-1792889-B1 Process for the preparation of carboxylic acid esters SUMITOMO CHEMICAL CO (JP) 2015-03-04 EP disclosed
EP-1547995-B1 Process for the preparation of carboxylic acid esters SUMITOMO CHEMICAL CO (JP) 2014-05-07 EP disclosed
EP-1253135-B1 Asymmetric copper complex and cyclopropanation reaction using the same SUMITOMO CHEMICAL CO (JP) 2010-11-24 EP disclosed
US-7741511-B2 Process for the preparation of carboxylic acid esters SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-22 US disclosed
US-7399873-B2 Process for the preparation of carboxylic acid esters SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-07-15 US disclosed
JP-S5583704-A INSECTICIDE KURARAY CO LTD 1980-06-24 JP disclosed
EP-0003683-A3 PROCESS FOR PREPARING HIGH CIS 3-(2,2,2-TRICHLOROETHYL)-2,2-DIMETHYLCYCLOPROPANE-1-CARBOXYLATES 1979-09-05 EP disclosed
US-4166064-A 4,6,6,6 -TETRACHLORO-3,3-DIMETHYLHEXANOATE, ALKALI METAL TERT-ALKOXIDE FMC CORPORATION (US) 1979-08-28 US disclosed
US-4166064-A 4,6,6,6 -TETRACHLORO-3,3-DIMETHYLHEXANOATE, ALKALI METAL TERT-ALKOXIDE FMC CORPORATION (US) 1979-08-28 US disclosed
US-4166064-A 4,6,6,6 -TETRACHLORO-3,3-DIMETHYLHEXANOATE, ALKALI METAL TERT-ALKOXIDE FMC CORPORATION (US) 1979-08-28 US disclosed
EP-0003683-A2 Process for preparing high cis 3-(2,2,2-trichloroethyl)-2,2-dimethylcyclopropane-1-carboxylates FMC Corporation (US) 1979-08-22 EP disclosed
EP-0003683-A2 Process for preparing high cis 3-(2,2,2-trichloroethyl)-2,2-dimethylcyclopropane-1-carboxylates FMC Corporation (US) 1979-08-22 EP disclosed
JP-S5295638-A CYCLOPROPANECARBAXYLIC ACID DERIVATIVES SANKYO CO LTD 1977-08-11 JP disclosed