SCHEMBL1670177

SCHEMBL1670177

C#C[CH]CC=C

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
SCHEMBL8186596 0.71
SCHEMBL4667280 0.69
SCHEMBL31260201 0.69
SCHEMBL27883313 0.69
SCHEMBL44197 0.69
Benzene SCHEMBL28229669 0.67 ALDH1A1 (0.31)
SCHEMBL14855844 0.67
SCHEMBL10703164 0.67
Ethyne SCHEMBL7610107 0.65
Methane SCHEMBL22749558 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110914342-A Linker compounds, methods of production thereof, and uses thereof 申卡尔工程和设计学院 2020-03-24 CN claimed
EP-3256462-B1 SUBSTITUTED 2-THIOIMIDAZOLYL-CARBOXAMIDES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2019-08-21 EP claimed
EP-3256462-A1 SUBSTITUTED 2-THIOIMIDAZOLYL-CARBOXAMIDES AS PEST CONTROL AGENTS Bayer CropScience Aktiengesellschaft (DE) 2017-12-20 EP claimed
WO-2016128298-A1 SUBSTITUTED 2-THIOIMIDAZOLYL-CARBOXAMIDES AS PEST CONTROL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-08-18 WO claimed
CN-102503867-A N-aryl-N-alkyl methylpropane-2-sulfinamide and application thereof UNIV CHENGDU TECHNOLOGY 2012-06-20 CN claimed
EP-0385267-A2 Pyridine derivatives, their preparation and their use as fungicides CIBA-GEIGY AG (CH) 1990-09-05 EP claimed
EP-0192055-B1 HYDROXYALKYNYL-AZOLYL DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES BAYER AG (DE) 1989-08-09 EP claimed
EP-0118120-B1 1,4-DIHYDROPYRIDINE COMPOUND NIKKEN CHEMICALS CO., LTD. (JP) 1989-06-14 EP claimed
EP-0101023-B1 PROCESS FOR PREPARING 2-CARBAMOYLOXYALKYL-1,4-DIHYDROPYRIDINE DERIVATIVES AND INTERMEDIATES USEFUL FOR THE PROCESS BANYU PHARMACEUTICAL CO., LTD. (JP) 1987-07-29 EP claimed
EP-0029171-B1 AZOLYLOXY-CARBOXYLIC ACID N-OXY-AMIDES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION, THEIR USE, HERBICIDES CONTAINING THEM AND THEIR PREPARATION BAYER AG (DE) 1984-03-21 EP claimed
JP-60081171-A None JP disclosed
US-11964938-B2 3-phenyl-4-hexynoic acid derivatives as GPR40 agonists CELON PHARMA S.A. (PL) 2024-04-23 US disclosed
EP-3737470-B9 3-PHENYL-4-HEXYNOIC ACID DERIVATIVES AS GPR40 AGONISTS Celon Pharma Sa (PL) 2024-03-13 EP disclosed
US-11858887-B2 Linker compounds, methods of producing the same and uses thereof SHENKAR COLLEGE OF ENGINEERING AND DESIGN (IL) 2024-01-02 US disclosed
CN-115668569-A Electrolyte solution, electrochemical device, lithium ion secondary battery, and assembly 大金工业株式会社 2023-01-31 CN disclosed
US-5053071-A For cereal crops E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-10-01 US disclosed
JP-S6081171-A KETENE-S,N-ACETAL, PRODUCTION THEREOF AND GERMICIDE CONTAINING SAID COMPOUND NIPPON NOHYAKU CO LTD 1985-05-09 JP disclosed
US-3968244-A Chemosterilant and larvicidal imidothiocarbonates AMERICAN CYANAMID COMPANY (US) 1976-07-06 US disclosed
US-3856896-A ALKYL PROPARGYL PHOSPHONATES JOHNSON & SON INC S C 1974-12-24 US disclosed
US-3856896-A ALKYL PROPARGYL PHOSPHONATES JOHNSON & SON INC S C 1974-12-24 US disclosed