SCHEMBL458931

SCHEMBL458931

Clc1cc[c]c(C2CC2)c1

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
SCHEMBL1116702 0.92 CEL (0.34)
SCHEMBL434766 0.90 CEL (0.36)
SCHEMBL10631828 0.90 CEL (0.36)
SCHEMBL5106428 0.87 HTR3A (0.41)
SCHEMBL4049303 0.84 DRD4 (0.40)
SCHEMBL4075115 0.74 PTGS1 (0.31)
SCHEMBL457257 0.74 HTR2C (0.32)
SCHEMBL6446557 0.74
SCHEMBL18007678 0.72 TSHR (0.35)
SCHEMBL1778645 0.71 KMO (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239755-A1 SUBSTITUTED PYRIDAZINONES, SALTS OR N-OXIDES THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2024-07-18 US claimed
EP-4330234-A1 SUBSTITUTED PYRIDAZINONES, SALTS OR N-OXIDES THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2024-03-06 EP claimed
CN-117222625-A Substituted pyridazinones, salts or N-oxides thereof and their use as herbicidal agents 拜耳公司 2023-12-12 CN claimed
CN-108431009-A Substituted indazole compound and application thereof as ROR γ T inhibitor 默沙东公司 2018-08-21 CN claimed
CN-107750250-A Indolone compounds and their use as ampa receptor modulators 詹森药业有限公司 2018-03-02 CN claimed
CN-107735401-A Substituted Dihydropyrrolopyrazole Derivatives 宇部兴产株式会社 2018-02-23 CN claimed
CN-107635970-A BENZIMIDAZOLONE AND BENZOTHIAZOLONE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS 詹森药业有限公司 2018-01-26 CN claimed
CN-101600700-B Novel 2-amino oxazolines as TAAR1 ligands for CNS disorders HOFFMANN LA ROCHE 2013-08-21 CN claimed
US-20240239755-A1 SUBSTITUTED PYRIDAZINONES, SALTS OR N-OXIDES THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2024-07-18 US disclosed
EP-4330234-A1 SUBSTITUTED PYRIDAZINONES, SALTS OR N-OXIDES THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2024-03-06 EP disclosed
CN-117222625-A Substituted pyridazinones, salts or N-oxides thereof and their use as herbicidal agents 拜耳公司 2023-12-12 CN disclosed
US-10336698-B2 Process for the production of 2-[4-(cyclopropanecarbonyl)phenyl]-2-methyl-propanenitrile SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2019-07-02 US disclosed
CN-106536512-B Carboxamides derivatives 诺华股份有限公司 2019-06-07 CN disclosed
EP-3247699-B1 PROCESS FOR THE PRODUCTION OF 2-[4-(CYCLOPROPANECARBONYL)PHENYL]-2-METHYL-PROPANENITRILE SANOFI AVENTIS DEUTSCHLAND (DE) 2019-05-15 EP disclosed
US-5387607-A Fungicides BASF AKTIENGESELLSCHAFT (DE) 1995-02-07 US disclosed
US-5292759-A O-benzyloxime ethers and crop protection agents containing these compounds BASF AKTIENGESELLSCHAFT (DE) 1994-03-08 US disclosed
US-5194662-A Insecticides, fungicides for plants BASF AKTIENGESELLSCHAFT (DE) 1993-03-16 US disclosed
US-5174997-A Fungicides tolerated by plants BASF AKTIENGESELLSCHAFT (DE) 1992-12-29 US disclosed
US-4243407-A 2-Acylaminothiazol-4-ylacetamides as post emergent selective herbicides GULF OIL CORPORATION (US) 1981-01-06 US disclosed
US-4232163-A 2-Acylaminothiazol-4-ylacetamides as post emergent selective herbicides GULF OIL CORPORATION (US) 1980-11-04 US disclosed