SCHEMBL3965792

SCHEMBL3965792

CC(=O)OC(C)[N+](=O)[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
SCHEMBL19582821 0.82 TSHR (0.32)
SCHEMBL19582823 0.80
SCHEMBL8747972 0.78
SCHEMBL6418360 0.78 TSHR (0.41)
SCHEMBL23923757 0.76 TSHR (0.44)
SCHEMBL8374780 0.74
SCHEMBL6854817 0.73 TSHR (0.41)
SCHEMBL27615987 0.73 TSHR (0.41)
SCHEMBL11107549 0.72 TDP1 (0.32)
SCHEMBL9423271 0.72 TSHR (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116640089-A Synthesis method of N-BOC-4-amino-4-carboxylic acid piperidine 深圳市茵诺圣生物科技有限公司 2023-08-25 CN claimed
CN-104217912-B For the precursor for the plane delamination that semiconductor devices is carried out using focused ion beam FEI 公司 2018-02-06 CN claimed
CN-104217912-A Precursor for Planar Deprocessing of Semiconductor Devices using a Focused Ion Beam FEI CO 2014-12-17 CN claimed
CN-113994970-B Substituted sulfonamides for combating animal pests 拜耳公司 2023-05-12 CN disclosed
CN-113994970-A Substituted sulfonamides for combating animal pests 拜耳公司 2022-02-01 CN disclosed
EP-3683222-B1 NOVEL BICYCLIC OR TRICYCLIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORP (JP) 2021-10-06 EP disclosed
US-20210289794-A1 COMPOSITIONS AND RELATED METHODS FOR AGRICULTURE FLAGSHIP PIONEERING INNOVATIONS V, INC. 2021-09-23 US disclosed
WO-2021027729-A1 IMMUNOMODULATOR 成都先导药物开发股份有限公司 2021-02-18 WO disclosed
WO-2021027722-A1 IMMUNOMODULATOR 成都先导药物开发股份有限公司 2021-02-18 WO disclosed
US-10820591-B2 Substituted sulfonyl amides for controlling animal pests BAYER AKTIENGESELLSCHAFT (DE) 2020-11-03 US disclosed
EP-3683222-A1 NOVEL BICYCLIC OR TRICYCLIC HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2020-07-22 EP disclosed
EP-2471789-A1 FUSED HETEROCYCLIC RING DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2012-07-04 EP disclosed
CN-102245181-A Heterocyclic benzimidazoles as TRPM8 modulators JANSSEN PHARMACEUTICA NV 2011-11-16 CN disclosed
WO-2009049018-A1 NOVEL COMPOUNDS AND METHODS OF USING THEM SYNDAX PHARMACEUTICALS, INC. (US) 2009-04-16 WO disclosed
CN-1901971-A Cyclopropane compounds and pharmaceutical use thereof JAPAN TOBACCO INC (JP) 2007-01-24 CN disclosed
CN-1575283-A Piperazine derivatives having CCR1 receptor antagonist activity PFIZER PROD INC (US) 2005-02-02 CN disclosed
US-6610977-B2 Security system for NBC-safe building LOCKHEED MARTIN CORPORATION 2003-08-26 US disclosed
US-4469703-A FUNGICIDES EGYT GYOGYSZERVEGYESZETI GYAR (HU) 1984-09-04 US disclosed
US-4087438-A Thieno[3,4-d]furoxan and process for its preparation SYNTEX (U.S.A.) INC. (US) 1978-05-02 US disclosed
US-4044020-A Process for preparing biotin SYNTEX (U.S.A.) INC. (US) 1977-08-23 US disclosed