SCHEMBL42167

SCHEMBL42167

CNC([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
Thioacetamide SCHEMBL28077744 0.79
Bicarbonate SCHEMBL49808 0.74 CA2 (0.56)
Bicarbonate SCHEMBL16993794 0.74 CA2 (0.56)
Bicarbonate SCHEMBL12614336 0.74 CA2 (0.56)
Bicarbonate SCHEMBL16993798 0.74 CA2 (0.56)
Bicarbonate SCHEMBL49809 0.74
Bicarbonate SCHEMBL7900777 0.73
Bicarbonate SCHEMBL27653273 0.70
SCHEMBL4397 0.70
SCHEMBL20411614 0.70

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

Appears in 4143 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118239868-A Carbamate substituted styryl sulfone compound and preparation method and application thereof 华夏生生药业(北京)有限公司 2024-06-25 CN claimed
EP-4001263-B1 CARBAMATE-SUBSTITUTED STYRYL SULFONE COMPOUND, PREPARATION METHOD, AND APPLICATION THEREOF HUAXIASHENGSHENG PHARMACEUTICAL BEIJING CO LTD (CN) 2024-03-27 EP claimed
EP-3654987-B1 USE OF AMINOALKYLBENZOTHIAZEPINE DERIVATIVES HK INNO N CORP (KR) 2022-08-31 EP claimed
EP-4001263-A1 CARBAMATE-SUBSTITUTED STYRYL SULFONE COMPOUND, PREPARATION METHOD, AND APPLICATION THEREOF Huaxiashengsheng Pharmaceutical Beijing Co., Ltd. (CN) 2022-05-25 EP claimed
CN-114072380-A Carbamate substituted styryl sulfone compound and preparation method and application thereof 华夏生生药业(北京)有限公司 2022-02-18 CN claimed
US-11202783-B2 Use of aminoalkylbenzothiazepine derivatives CJ HEALTHCARE CORPORATION (KR) 2021-12-21 US claimed
CN-107949562-B Positive allosteric modulators of muscarinic M2 receptors 拜耳制药股份公司 2021-07-23 CN claimed
US-20200390100-A1 SUBSTITUTED N-HETEROCYCLYL- AND N-HETEROARYL-TETRAHYDROPYRIMIDINONES AND THE SALTS THEREOF, AND THE USE OF SAME AS HERBICIDAL ACTIVE SUBSTANCES BAYER AG (DE) 2020-12-17 US claimed
EP-3307741-B1 POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARIC M2 RECEPTOR Bayer Pharma AG (DE) 2020-10-28 EP claimed
EP-3728214-A1 SUBSTITUTED N-HETEROCYCLYL- AND N-HETEROARYL-TETRAHYDROPYRIMIDINONES AND THE SALTS THEREOF, AND THE USE OF SAME AS HERBICIDAL ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2020-10-28 EP claimed
US-4263037-A 5-Cyano-2,3-dihydrobenzofurans useful as herbicides FISONS LIMITED (GB) 1981-04-21 US claimed
US-4234578-A ANTIBIOTICS CIBA-GEIGY CORPORATION (US) 1980-11-18 US claimed
EP-0007719-A2 Cyanbenzofuran derivatives, processes for their preparation and their use in herbicidal compositions; cyanobenzene, benzodioxepine, benzodioxaphosphepine and benzodioxathiepine derivatives FBC LIMITED (GB) 1980-02-06 EP claimed
US-4175125-A USING HALOGENATED PHENYLTHIOACETAMIDO CEPHALOSPORANIC ACID DERIVAT ELI LILLY AND COMPANY (US) 1979-11-20 US claimed
US-4145540-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1979-03-20 US claimed
US-4140684-A FOR POLYESTERS, POLYAMIDES, AND CELLULOSE ACETATES FIDELITY UNION TRUST COMPANY, EXECUTIVE TRUSTEE UNDER THE SANDOZ TRUST (US) 1979-02-20 US claimed
US-4140768-A INSECTICIDES, FUNGICIDES, MITICIDES, NEMATOCIDES BAYER AKTIENGESELLSCHAFT (DE) 1979-02-20 US claimed
US-4117148-A ANALGESICS, ANTIPYRETICS, ANTIINFLAMMATORY KALI-CHEMIE PHARMA GMBH. (DE) 1978-09-26 US claimed
US-4009158-A DYEING AND PRINTING FIBERS SANDOZ LTD. (CH) 1977-02-22 US claimed
US-3958003-A HETEROCYCLIC COMPOUND, ANALGESICS CENTRAL NERVOUS SYSTEM DEPRESSANT SANDOZ LTD. (CH) 1976-05-18 US claimed