SCHEMBL4869307

SCHEMBL4869307

C[C](C)COC(C)=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
SCHEMBL10458150 0.80 ALDH1A1 (0.53)
SCHEMBL4688208 0.80 ALDH1A1 (0.53)
SCHEMBL10530238 0.80 ALDH1A1 (0.53)
SCHEMBL36403 0.80
SCHEMBL311876 0.80 ALDH1A1 (0.53)
SCHEMBL10530231 0.80 ALDH1A1 (0.53)
SCHEMBL1214744 0.78
SCHEMBL4103921 0.78 ALDH1A1 (0.50)
SCHEMBL16585534 0.78
SCHEMBL2726082 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0033088-B1 ANTIMYCOTIC AGENTS BAYER AG (DE) 1983-05-25 EP claimed
EP-0033088-A2 Antimycotic agents BAYER AG (DE) 1981-08-05 EP claimed
US-20220194907-A1 PROCESS FOR THE PREPARATION OF MICROBIOCIDAL OXADIAZOLE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2022-06-23 US disclosed
US-11180462-B2 Microbiocidal oxadiazole derivatives SYNGENTA PARTICIPATIONS AG (CH) 2021-11-23 US disclosed
US-11066375-B2 Microbiocidal oxadiazole derivatives SYNGENTA PARTICIPATIONS AG (CH) 2021-07-20 US disclosed
EP-3356335-B1 MICROBIOCIDAL OXADIAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2021-06-30 EP disclosed
US-10899724-B2 Microbiocidal oxadiazole derivatives SYNGENTA PARTICIPATIONS AG (CH) 2021-01-26 US disclosed
EP-3283550-B1 CATALYST CONTAINING AMIDINE GROUPS SIKA TECH AG (CH) 2020-12-16 EP disclosed
EP-3294803-B1 GUANIDINE GROUP CONTAINING CATALYST SIKA TECH AG (CH) 2020-12-09 EP disclosed
CN-107428941-B Amidino group-containing catalyst SIKA技术股份公司 2020-11-24 CN disclosed
US-20200181100-A1 MICROBIOCIDAL OXADIAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2020-06-11 US disclosed
EP-0057357-A2 Plant growth stunting agent BAYER AG (DE) 1982-08-11 EP disclosed
US-4316932-A Combating fungi with α-azolyl-keto derivatives BAYER AKTIENGESELLSCHAFT (DE) 1982-02-23 US disclosed
US-4315764-A FUNGICIDES, PLANT GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1982-02-16 US disclosed
EP-0007506-B1 DERIVATIVES OF ALPHA-AZOLYL KETONES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES BAYER AG (DE) 1981-11-18 EP disclosed
EP-0007505-B1 ALPHA-AZOLYL-BETA-HYDROXY-KETONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES BAYER AG (DE) 1981-09-30 EP disclosed
US-4291047-A Combating fungi with α-azolyl-β-hydroxy-ketones BAYER AKTIENGESELLSCHAFT (DE) 1981-09-22 US disclosed
EP-0033088-A2 Antimycotic agents BAYER AG (DE) 1981-08-05 EP disclosed
EP-0033088-A2 Antimycotic agents BAYER AG (DE) 1981-08-05 EP disclosed
EP-0016323-A1 1-Allyltriazole derivatives, process for their preparation and their use as plant protecting agents BAYER AG (DE) 1980-10-01 EP disclosed