SCHEMBL3115191

SCHEMBL3115191

C=CC(C)OC=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
SCHEMBL3669654 0.75
SCHEMBL10404086 0.75
SCHEMBL1013528 0.73
SCHEMBL6616131 0.73
SCHEMBL1456499 0.72
SCHEMBL6720340 0.72
SCHEMBL10403892 0.71
SCHEMBL3466853 0.69
SCHEMBL2260752 0.69
SCHEMBL4453911 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107324974-B Method for the simultaneous production of methallyl alcohol and amides 浙江大学宁波理工学院 2021-01-26 CN claimed
CN-107324974-A The method for preparing methallyl alcohol and acid amides simultaneously 浙江大学宁波理工学院 2017-11-07 CN claimed
EP-1095027-B1 SUBSTITUTED PHENYL URACILS BAYER CROPSCIENCE AG (DE) 2005-06-15 EP claimed
CN-107324974-B Method for the simultaneous production of methallyl alcohol and amides 浙江大学宁波理工学院 2021-01-26 CN disclosed
CN-107324974-B Method for the simultaneous production of methallyl alcohol and amides 浙江大学宁波理工学院 2021-01-26 CN disclosed
CN-108368373-A Coating composition and coated-body 旭硝子株式会社 2018-08-03 CN disclosed
CN-107324974-A The method for preparing methallyl alcohol and acid amides simultaneously 浙江大学宁波理工学院 2017-11-07 CN disclosed
CN-107324974-A The method for preparing methallyl alcohol and acid amides simultaneously 浙江大学宁波理工学院 2017-11-07 CN disclosed
US-9580444-B2 Polycyclic pyrazolinone derivative and herbicide comprising same as effective component thereof SAGAMI CHEMICAL RESEARCH INSTITUTE (JP) 2017-02-28 US disclosed
CN-103140287-B Use the ester exchange method of salt-mixture acetylacetonate catalyst 埃科辛斯私人有限公司 2016-08-03 CN disclosed
US-20160024110-A1 POLYCYCLIC PYRAZOLINONE DERIVATIVE AND HERBICIDE COMPRISING SAME AS EFFECTIVE COMPONENT THEREOF KAKEN PHARMACEUTICAL CO., LTD. (JP) 2016-01-28 US disclosed
EP-0180897-B1 5-FLUOROURACIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-08-07 EP disclosed
EP-0436902-A1 5-Fluorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-07-17 EP disclosed
US-4983609-A Anticancer agents OTSUKA PHARMACEUTICAL (JP) 1991-01-08 US disclosed
US-4892942-A 1-CARBA (DETHIA)CEPHALOSPORINS ELI LILLY AND COMPANY (US) 1990-01-09 US disclosed
US-4864021-A ANTICARCINOGENIC AGENTS, ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-09-05 US disclosed
EP-0323441-A2 5-Fluorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-07-05 EP disclosed
EP-0232623-A1 1-Carbacephalosporin antibiotics ELI LILLY AND COMPANY (US) 1987-08-19 EP disclosed
EP-0180897-A2 5-Fluorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-05-14 EP disclosed
US-4463169-A Three component, carboxyl-containing compositions comprising dimercaptan CIBA-GEIGY CORPORATION (US) 1984-07-31 US disclosed