SCHEMBL3891016

SCHEMBL3891016

C1CCC(P(CCP(C2CCCC2)C2CCCC2)C2CCCC2)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
SCHEMBL17585038 0.97
SCHEMBL301349 0.97
SCHEMBL17583691 0.94
SCHEMBL8000320 0.94
SCHEMBL15658123 0.93
Iodide SCHEMBL2831813 0.91
Hydrochloric Acid SCHEMBL2831284 0.91
Hydrochloric Acid SCHEMBL8383591 0.91
Hydrochloric Acid SCHEMBL17421810 0.91
Bromide SCHEMBL2828926 0.91

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4705268-A1 SELECTIVE SEMI-HYDROGENATION OF ALLENE Firmenich SA (CH) 2026-03-11 EP claimed
WO-2024227909-A1 SELECTIVE SEMI-HYDROGENATION OF ALLENE FIRMENICH SA (CH) 2024-11-07 WO claimed
US-20230167144-A1 PREPARATION AND ITS APPLICATION OF A CYANIDE-BRIDGED METAL ORGANIC COMPOUND WITH INTRAMOLECULAR MAGNETIC TRANSFORMATION Hubei Jingmen Industrial Technology Research Institute Co., Ltd. (CN) 2023-06-01 US claimed
US-20040176648-A1 One-step production of 1,3-propanediol from ethylene oxide and syngas with a cobalt-iron catalyst KNIFTON JOHN FREDERICK (US) 2004-09-09 US claimed
US-20030027717-A1 One-step production of 1, 3-propanediol from ethylene oxide and syngas with a cobalt-iron catalyst SHELL OIL COMPANY 2003-02-06 US claimed
EP-4705268-A1 SELECTIVE SEMI-HYDROGENATION OF ALLENE Firmenich SA (CH) 2026-03-11 EP disclosed
US-20250179043-A1 PROCESSES FOR THE PREPARATION OF N-(1-METHYLCYCLOPROPYL)-2-(3-PYRIDINYL)-2H-INDAZOLE-4-CARBOXAMIDE AND INTERMEDIATES THEREOF FMC CORP (US) 2025-06-05 US disclosed
US-20250163010-A1 PROCESSES FOR THE PREPARATION OF N-(1-METHYLCYCLOPROPYL)-2-(3-PYRIDINYL)-2H-INDAZOLE-4-CARBOXAMIDE AND INTERMEDIATES THEREOF FMC CORP (US) 2025-05-22 US disclosed
US-20250154124-A1 PROCESSES FOR THE PREPARATION OF N-(1-METHYLCYCLOPROPYL)-2-(3-PYRIDINYL)-2H-INDAZOLE-4-CARBOXAMIDE AND INTERMEDIATES THEREOF FMC CORP (US) 2025-05-15 US disclosed
WO-2024227909-A1 SELECTIVE SEMI-HYDROGENATION OF ALLENE FIRMENICH SA (CH) 2024-11-07 WO disclosed
CN-118715212-A Preparation of N- (1-methylcyclopropyl) -2- (3-pyridinyl) -2H-indazole-4-carboxamide and intermediates thereof FMC公司 2024-09-27 CN disclosed
CN-118715213-A Process for preparing N- (1-methylcyclopropyl) -2- (3-pyridinyl) -2H-indazole-4-carboxamide and intermediates thereof FMC公司 2024-09-27 CN disclosed
US-6518466-B2 Making an improved oxirane hydroformylation catalyst by forming a complex by contacting a ruthenium(0) compound and a ditertiary phosphine ligand, and undergoing a redox reaction with a cobalt(0) carbonyl compound SHELL OIL COMPANY 2003-02-11 US disclosed
US-20030027717-A1 One-step production of 1, 3-propanediol from ethylene oxide and syngas with a cobalt-iron catalyst SHELL OIL COMPANY 2003-02-06 US disclosed
WO-2002094437-A1 ONE-STEP PRODUCTION OF 1, 3-PROPANEDIOL FROM ETHYLENE OXIDE AND SYNGAS WITH A COBALT-IRON CATALYST SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2002-11-28 WO disclosed
US-20020161251-A1 One step process for preparing a 1,3-diol KNIFTON JOHN FREDERICK (US) 2002-10-31 US disclosed
US-6468940-B1 COMPLEX OF OXIDIZED RUTHINIUM METAL THAT IS LIGATED BY A TERTIARY DIPHOSPHINE LIGAND AND A COBALT COMPOUND WHICH IS NOT LIGATED BY A DIPHOSPHINE LIGAND; 1,3-PROPANEDIOL FROM HYDROFORMYLATION OF ETHYLENE OXIDE WITH SYNTHESIS GAS SHELL OIL COMPANY 2002-10-22 US disclosed
US-6469222-B2 OXIRANE HYDROFORMYLATION CATALYST SHELL OIL COMPANY 2002-10-22 US disclosed
US-20020111516-A1 One Step Process for preparing a 1,3-diol KNIFTON JOHN FREDERICK (US) 2002-08-15 US disclosed
US-20020004617-A1 One step process for preparing A 1,3-DIOL SHELL OIL COMPANY 2002-01-10 US disclosed