SCHEMBL1102253

SCHEMBL1102253

S=CN1CCOCC1

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
SCHEMBL28099806 0.82
SCHEMBL7709421 0.73 MGLL (0.40)
SCHEMBL454529 0.71
SCHEMBL454530 0.71
SCHEMBL9142690 0.71
SCHEMBL2159466 0.69
SCHEMBL82948 0.69
SCHEMBL11841381 0.69
SCHEMBL9789562 0.69
SCHEMBL28853111 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 105 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107759581-A Substituted benzoyl isoxazole class compound or its dynamic isomer, salt, preparation method, Herbicidal combinations and application 青岛清原化合物有限公司 2018-03-06 CN claimed
CN-107652217-A Substituted benzoyl diketone nitrile compounds or its dynamic isomer, salt, preparation method, Herbicidal combinations and application 青岛清原化合物有限公司 2018-02-02 CN claimed
CN-107353238-A Substituted benzoylcyclohexan cyclohexadione compounds or its dynamic isomer, salt, preparation method, Herbicidal combinations and application 青岛清原化合物有限公司 2017-11-17 CN claimed
EP-1188755-B1 ACYLHYDRAZINE DERIVATIVES, PROCESS FOR PREPARING THE SAME AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2006-05-03 EP claimed
EP-1082303-B1 HETEROCYCLIC DERIVATIVES WHICH INHIBIT FACTOR XA ASTRAZENECA AB (SE) 2005-01-26 EP claimed
US-6531496-B1 Pesticides in crop protection BAYER AKTIENGESELLSCHAFT (DE) 2003-03-11 US claimed
JP-2002543068-A 2002-12-17 JP claimed
US-6403595-B1 ANTICOAGULANTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-06-11 US claimed
EP-1173428-A1 O-ARYL DITHIAZOLE DIOXIDES Bayer Aktiengesellschaft (DE) 2002-01-23 EP claimed
WO-2000064881-A1 O-ARYL DITHIAZOLE DIOXIDES BAYER AKTIENGESELLSCHAFT (DE) 2000-11-02 WO claimed
EP-0649843-B1 THIAZOLINE DERIVATIVE TAISHO PHARMACEUTICAL CO LTD (JP) 2000-09-06 EP claimed
US-5478945-A Fibrinogen receptor antagonism and cell adhesion factor antagonism TAISHO PHARMACEUTICAL CO., LTD. (JP) 1995-12-26 US claimed
EP-0649843-A1 THIAZOLINE DERIVATIVE TAISHO PHARMACEUTICAL CO. LTD (JP) 1995-04-26 EP claimed
US-4902336-A N-ARYLSULFONYL-N'-(4-MERCAPTOMETHYL-PYRIMIDINYLUREA CIBA-GEIGY CORPORATION (US) 1990-02-20 US claimed
US-4786315-A PLANT GROWTH REGULATORS CIBA-GEIGY CORPORATION (US) 1988-11-22 US claimed
EP-0139612-B1 HERBICIDAL AGENT CIBA-GEIGY AG (CH) 1988-02-10 EP claimed
EP-0139612-A1 Herbicidal agent CIBA-GEIGY AG (CH) 1985-05-02 EP claimed
US-4410522-A BACTERICIDES TOYAMA CHEMICAL CO., LTD. (JP) 1983-10-18 US claimed
US-4327097-A BACTERICIDES FOR MAMMALS TOYAMA CHEMICAL CO., LTD. (JP) 1982-04-27 US claimed
US-4219554-A Novel penicillins and cephalosporins and process for producing same TOYAMA CHEMICAL COMPANY, LIMITED (JP) 1980-08-26 US claimed