SCHEMBL945093

SCHEMBL945093

O=[C]NC(=O)CCl

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
SCHEMBL9318305 0.74
SCHEMBL4845737 0.74
SCHEMBL5635901 0.73
SCHEMBL648902 0.71
SCHEMBL6970369 0.71
SCHEMBL9832153 0.67 ALDH1A1 (0.50)
SCHEMBL28337047 0.67
SCHEMBL1876546 0.67
SCHEMBL9026434 0.67
SCHEMBL6963193 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP claimed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US claimed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO claimed
CN-1051703-C Oxaspiro [2,5] octane derivative FUJISAWA PHARMACEUTICAL CO (JP) 2000-04-26 CN claimed
EP-0359036-B1 Fumagillol derivatives TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1997-03-26 EP claimed
EP-0461427-B1 Cyclodextrin complex TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1997-02-19 EP claimed
EP-0357061-B1 Angiogenesis inhibitory agent TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1994-06-08 EP claimed
CN-1024193-C Process for preparing oxaspiro [2, 5] octane derivatives FUJISAWA PHARMACEUTICAL CO (JP) 1994-04-13 CN claimed
US-5290807-A Antiinflammatory agents CHILDREN'S MEDICAL CENTER CORPORATION (US) 1994-03-01 US claimed
CN-1079898-A Preparation contains the method for the pharmaceutical composition of oxaspiro [2,5] Octane derivatives and salt thereof FUJISAWA PHARMACEUTICAL CO (JP) 1993-12-29 CN claimed
US-5202459-A Process for producing cyclobutane derivative NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1993-04-13 US claimed
US-5196406-A Antitumor, antiinflammatory TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-03-23 US claimed
EP-0461427-A2 Cyclodextrin complex Takeda Chemical Industries, Ltd. (JP) 1991-12-18 EP claimed
CN-107158398-A The MetAP2 inhibitor and its treatment method of application of polymeric conjugation 辛德弗雷克斯公司 2017-09-15 CN disclosed
CN-107141410-A The MetAP2 inhibitor and its treatment method of application of polymeric conjugation 辛德弗雷克斯公司 2017-09-08 CN disclosed
CN-103140512-B Polymer-conjugated MetAP2 inhibitors and methods of treatment using the same 辛德弗雷克斯公司 2017-03-01 CN disclosed
US-4395411-A ANTIBIOTICS; BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-07-26 US disclosed
US-4267176-A Amino or acylamino-substituted pyrimidinyl cephalosporanic acid derivatives and pharmaceutical compositions thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-05-12 US disclosed
US-3992402-A OR FUNGICIDAL 5-POLYHALOETHYLIMINO- AND 5-POLYHALOVINYLIMINO-2,4-IMIDAZOLIDINEDIONES CHEVRON RESEARCH COMPANY (US) 1976-11-16 US disclosed
US-3767376-A HERBICIDES 1-ALIPHATIC-3-ARYL-5-IMINO IMIDAZOLIDINE-2,4-DIONES AND IMIDAZOLIDINE-2-ONE-4-THIONES CHEVRON RES 1973-10-23 US disclosed