SCHEMBL4940

SCHEMBL4940

C[CH]C1CCCCC1

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
SCHEMBL8183865 1.00 ADH1C (0.32)
SCHEMBL3032794 1.00 ADH1C (0.32)
SCHEMBL8185975 1.00 ADH1C (0.32)
SCHEMBL8186468 1.00 ADH1C (0.32)
SCHEMBL5175 1.00
SCHEMBL4944 1.00 ADH1C (0.32)
SCHEMBL8922 0.96
SCHEMBL5296 0.89
SCHEMBL20607552 0.82 ALDH1A1 (0.44)
SCHEMBL8186496 0.82

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 19819 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12043719-B2 Flame retardant mixture CLARIANT INTERNATIONAL LTD (CH) 2024-07-23 US claimed
CN-118344355-A Quinazolinone derivative, preparation method thereof and application thereof in anti-inflammatory and anti-tumor 贵州省天然产物研究中心 2024-07-16 CN claimed
EP-4168510-B1 PHOSPHORUS-CONTAINING FLAME RETARDANT MIXTURES, A PROCESS FOR PRODUCTION OF SAID MIXTURES AND USE OF SAID MIXTURES, AND ALSO EPOXY RESIN FORMULATIONS WHICH COMPRISE SAID FLAME RETARDANT MIXTURES CLARIANT INT LTD (CH) 2024-07-10 EP claimed
WO-2024140062-A1 THIOXANTHENIUM SALT PHOTOINITIATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 常州强力电子新材料股份有限公司 2024-07-04 WO claimed
WO-2024140063-A1 THIOXANTHENE SULFONIUM SALT PHOTOINITIATOR AS WELL AS PREPARATION METHOD THEREFOR AND USE THEREOF 常州强力电子新材料股份有限公司 2024-07-04 WO claimed
CN-118271281-A Thioxanthene sulfonium salt photoinitiator and preparation method and application thereof 常州强力电子新材料股份有限公司 2024-07-02 CN claimed
CN-118271280-A Thioxanthene sulfonium salt photoinitiator and preparation method and application thereof 常州强力电子新材料股份有限公司 2024-07-02 CN claimed
US-20240209281-A1 2,4-DIMETHYLOCTA-2,7-DIEN-4-OL AS AN ODORIFEROUS SUBSTANCE SYMRISE AG (DE) 2024-06-27 US claimed
US-20240207253-A1 Inhibitors of CDR1 for Reversal of Azole Drug Resistance in Fungal Infections THE UNITED STATES GOVERNMENT AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS 2024-06-27 US claimed
US-20240141254-A1 2,6,6-TRIMETHYL-NORPINAN-2-OL AS AN ODORIFEROUS SUBSTANCE SYMRISE AG (DE) 2024-05-02 US claimed
EP-0048828-A1 Substituted 2,4-dichlorophenyl-imidazolyl-vinyl carbinols, process for their preparation and antimicrobial agents containing these compounds BAYER AG (DE) 1982-04-07 EP claimed
EP-0048827-A1 Substituted 2,4-dichlorophenyl-imidazolyl-vinyl ketones, processes for their preparation and antimicrobial agents containing these compounds BAYER AG (DE) 1982-04-07 EP claimed
US-4316015-A 6H-1,2,4,6-Thiatriazine-1,1-dioxides BASF AKTIENGESELLSCHAFT (DE) 1982-02-16 US claimed
US-4207332-A Prostaglandin I2 analogues ONO PHARMACEUTICAL CO., LTD. (JP) 1980-06-10 US claimed
EP-0009000-A1 Metal salt complexes; their use as agents for bonding vulcanizable elastomers to metallic surfaces CIBA-GEIGY AG (CH) 1980-03-19 EP claimed
US-4178367-A Prostaglandin I2 analogues ONO PHARMACEUTICAL CO. LTD. (JP) 1979-12-11 US claimed
US-4154577-A Uniformly disperse dyed water-swellable cellulosic fibers BASF AKTIENGESELLSCHAFT (DE) 1979-05-15 US claimed
US-4116665-A Method of regulating the growth of aquatic weeds with pyridine derivatives ELI LILLY AND COMPANY (US) 1978-09-26 US claimed
US-4064135-A Certain thiazole-5-carboxamide compounds SYNTEX (U.S.A.) INC. (US) 1977-12-20 US claimed
US-3932436-A 2-Thiazolone-5-carboxylic acid ester fungicidal agents BAYER AKTIENGESELLSCHAFT (DT) 1976-01-13 US claimed