SCHEMBL6964110

SCHEMBL6964110

[O]C(=O)C1=CCC1

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
SCHEMBL2597101 0.80 HDAC4 (0.37)
SCHEMBL6965531 0.79
SCHEMBL17503288 0.78
SCHEMBL22290 0.78
SCHEMBL4104945 0.77
SCHEMBL10895454 0.75
SCHEMBL1259101 0.75
SCHEMBL22639100 0.75
SCHEMBL11674817 0.75 TSHR (0.50)
SCHEMBL11674811 0.75 TSHR (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117835980-A Tetrahydropyrazolopyridine analog ligand of NLRX1 and application thereof 朗多生物制药股份有限公司 2024-04-05 CN disclosed
CN-113748109-B Lanthionine C-like protein 2 ligands, cells prepared with said ligands and therapies using said ligands 朗多生物制药股份有限公司 2023-07-21 CN disclosed
CN-116368133-A NLRX1 ligand 朗多生物制药股份有限公司 2023-06-30 CN disclosed
CN-111621797-B Electrochemical reduction of carbon dioxide 国立研究开发法人科学技术振兴机构 2023-06-02 CN disclosed
CN-109312014-A Oligomerization catalyst and method for preparing ethylene oligomer using the same SK新技术株式会社 2019-02-05 CN disclosed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed
US-6300333-B1 COMPOUNDS AS FUNGICIDES, MITICIDES OR INSECTICIDES HOECHST SCHERING AGREVO GMBH (DE) 2001-10-09 US disclosed
US-6281221-B1 Substituted 1,3-dioxan-5-ylamino-hererocyclic compounds, processes for their preparation and their use as pest control compositions HOECHST SCERING AGREVO GMBH (DE) 2001-08-28 US disclosed
EP-1068197-A1 SUBSTITUTED PIPERIDINES, METHOD FOR THEIR PREPARATION AND THEIR USE AS PESTICIDES AND FUNGICIDES Aventis CropScience GmbH (DE) 2001-01-17 EP disclosed
US-6107299-A INSECTICIDES; MITICIDES HOECHST SCHERING AGREVO GMBH (DE) 2000-08-22 US disclosed
WO-1999051589-A1 SUBSTITUTED PIPERIDINES, METHOD FOR THEIR PREPARATION AND THEIR USE AS PESTICIDES AND FUNGICIDES AVENTIS CROPSCIENCE GMBH (DE) 1999-10-14 WO disclosed
US-5859009-A Substituted spiroalkylamino and alkoxy heterocycles, processes for their preparation, and their use as pesticides and fungicides HOECHST SCHERING AGREVO GMBH (DE) 1999-01-12 US disclosed
WO-1998051674-A1 SUBSTITUTED HETEROCYCLIC NITROGENS, METHODS FOR PRODUCING SAME AND THEIR USE AS PEST CONTROL AGENT HOECHST SCHERING AGREVO GMBH (DE) 1998-11-19 WO disclosed
EP-0836603-A1 SUBSTITUTED 1,3-DIOXAN-5-YLAMINO HETEROCYCLIC COMPOUNDS, METHODS FOR PREPARING THEM AND THEIR USE AS PESTICIDES Hoechst Schering AgrEvo GmbH (DE) 1998-04-22 EP disclosed
US-5691321-A INSECTICIDES, MITICIDES, PARASITICIDES HOECHST SCHERING AGREVO GMBH (DE) 1997-11-25 US disclosed
EP-0785934-A1 SUBSTITUTED SPIROALKYLAMINO AND SPIROALKOXY-HETEROCYCLES, PROCESS FOR PREPARING THE SAME AND THEIR USE AS PESTICIDES AND FUNGICIDES Hoechst Schering AgrEvo GmbH (DE) 1997-07-30 EP disclosed
EP-0759909-A1 HETEROCYCLYLAMINO- AND HETEROCYCLYLOXY-CYCLOALKYL DERIVATIVES, THEIR PREPARATION AND THEIR USE AS PESTICIDES AND FUNGICIDES Hoechst Schering AgrEvo GmbH (DE) 1997-03-05 EP disclosed
WO-1997002264-A1 SUBSTITUTED 1,3-DIOXAN-5-YLAMINO HETEROCYCLIC COMPOUNDS, METHODS FOR PREPARING THEM AND THEIR USE AS PESTICIDES HOECHST SCHERING AGREVO GMBH (DE) 1997-01-23 WO disclosed
WO-1996011924-A1 SUBSTITUTED SPIROALKYLAMINO AND SPIROALKOXY-HETEROCYCLES, PROCESS FOR PREPARING THE SAME AND THEIR USE AS PESTICIDES AND FUNGICIDES HOECHST SCHERING AGREVO GMBH (DE) 1996-04-25 WO disclosed
WO-1995031441-A1 HETEROCYCLYLAMINO- AND HETEROCYCLYLOXY-CYCLOALKYL DERIVATIVES, THEIR PREPARATION AND THEIR USE AS PESTICIDES AND FUNGICIDES HOECHST SCHERING AGREVO GMBH (DE) 1995-11-23 WO disclosed