SCHEMBL186738

SCHEMBL186738

C[C]=CC(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
SCHEMBL21351 1.00
SCHEMBL23665 1.00
SCHEMBL7760419 0.69
SCHEMBL10399846 0.67
SCHEMBL10394978 0.67
SCHEMBL5704286 0.67
SCHEMBL11405049 0.65
SCHEMBL7108978 0.64
SCHEMBL11664578 0.64
SCHEMBL9664882 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110564481-B Oil-soluble slurry containing graphene and preparation method and application thereof 南方科技大学 2022-03-25 CN claimed
CN-110484020-B Slurry and preparation method and application thereof 南方科技大学 2021-06-18 CN claimed
EP-3728237-A1 SUBSTITUTED THIOPHENYL URACILS, SALTS THEREOF AND THE USE THEREOF AS HERBICIDAL AGENTS Syngenta Crop Protection AG (CH) 2020-10-28 EP claimed
EP-3728235-A1 SUBSTITUTED THIOPHENYL URACILS, SALTS THEREOF AND THE USE THEREOF AS HERBICIDAL AGENTS Syngenta Crop Protection AG (CH) 2020-10-28 EP claimed
EP-3728214-A1 SUBSTITUTED N-HETEROCYCLYL- AND N-HETEROARYL-TETRAHYDROPYRIMIDINONES AND THE SALTS THEREOF, AND THE USE OF SAME AS HERBICIDAL ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2020-10-28 EP claimed
CN-110564481-A Oil-soluble slurry containing graphene and preparation method and application thereof 南方科技大学 2019-12-13 CN claimed
EP-3558986-A1 SUBSTITUTED 1,2,4-THIADIAZOLYL PYRROLONES AND 1,2,4-THIADIAZOLYL HYDANTOINES AND SALTS THEREOF AND USE THEREOF AS HERBICIDES Bayer CropScience Aktiengesellschaft (DE) 2019-10-30 EP claimed
EP-3558976-A1 SUBSTITUTED AZOLYLPYRROLONES AND AZOLYLHYDANTOINES AND SALTS THEREOF AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES Bayer CropScience Aktiengesellschaft (DE) 2019-10-30 EP claimed
US-8314271-B2 Selective preparation of some 2-alkoxy-ethanol derivatives FIRMENICH SA (CH) 2012-11-20 US claimed
EP-2200963-B1 SELECTIVE PREPARATION OF SOME 2-ALKOXY-ETHANOL DERIVATIVES FIRMENICH & CIE (CH) 2012-01-04 EP claimed
US-5229416-A Parasiticide, insecticide, antihelmintic MERCK & CO., INC. (US) 1993-07-20 US claimed
US-5208222-A Anthelemetic MERCK & CO., INC. (US) 1993-05-04 US claimed
US-5169839-A DERIVATIVES OF 3'- AND 3\"-O-DESMETHYL AVERMECTIN COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING MELMINTIC AND PARASITIC INFECTIONS MERCK & CO., INC. (US) 1992-12-08 US claimed
EP-0506331-A1 4\"-and 4'-alkylthio-avermectin derivatives MERCK & CO. INC. (US) 1992-09-30 EP claimed
EP-0456509-A1 Derivatives of 3' - and 3\"-0-desmethyl avermectin compounds MERCK & CO. INC. (US) 1991-11-13 EP claimed
US-5023241-A Parasiticides, anthelmintic, insecticides, miticides MERCK & CO., INC. (US) 1991-06-11 US claimed
EP-0411897-A2 Avermectin derivatives MERCK & CO. INC. (US) 1991-02-06 EP claimed
EP-0375393-A1 Avermectin derivatives MERCK & CO. INC. (US) 1990-06-27 EP claimed
EP-0214731-A2 Antiparasitic avermectin and milbemycin derivatives and process for their preparation Pfizer Limited (GB) 1987-03-18 EP claimed
CN-86105218-A The preparation method of antiparasitic agents 1987-03-04 CN claimed