⚠ 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL18658449 | 1.00 | — | — | |
| Ethylene Glycol SCHEMBL11586345 | 0.86 | — | — | |
| SCHEMBL7536215 | 0.78 | — | — | |
| SCHEMBL15738590 | 0.74 | — | — | |
| SCHEMBL76624 | 0.74 | — | — | |
| SCHEMBL17247994 | 0.73 | — | — | |
| SCHEMBL1015733 | 0.71 | — | — | |
| SCHEMBL28479783 | 0.71 | — | — | |
| SCHEMBL28484983 | 0.71 | — | — | |
| SCHEMBL10407817 | 0.71 | — | — |
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 175 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1140770-A1 | PROCESS FOR THE PREPARATION OF BETA-GAMMA UNSATURATED ESTERS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2001-10-10 | — | — | EP | claimed |
| WO-2001053249-A1 | PROCESS FOR THE CARBONYLATION OF BUTADIENE AND/OR AT LEAST ONE BUTADIENE DERIVATIVE | DSM N.V. (NL) | 2001-07-26 | — | — | WO | claimed |
| EP-1118607-A1 | Process for the carbonylation of butadiene and/or at least one butadiene derivative | DSM N.V. (NL) | 2001-07-25 | — | — | EP | claimed |
| WO-2000037411-A1 | PROCESS FOR THE PREPARATION OF BETA-GAMMA UNSATURATED ESTERS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2000-06-29 | — | — | WO | claimed |
| EP-0815070-B1 | METHOD OF PRODUCING 3-PENTENIC ACID ESTERS BY CARBONYLATION OF ALKOXYBUTENES | BASF AG (DE) | 2000-06-14 | — | — | EP | claimed |
| US-6075161-A | CATALYZING THE REACTION WITH CARBON MONOXIDE IN PRESENCE OF A PALLADIUM COMPOUND CATALYST AND A SOLVENT AT ELEVATED TEMPERATURE AND ELEVATED PRESSURE | BASF AKTIENGESELLSCHAFT (DE) | 2000-06-13 | — | — | US | claimed |
| EP-0815070-A1 | METHOD OF PRODUCING 3-PENTENIC ACID ESTERS BY CARBONYLATION OF ALKOXYBUTENES | BASF AKTIENGESELLSCHAFT (DE) | 1998-01-07 | — | — | EP | claimed |
| WO-1996029300-A1 | METHOD OF PRODUCING 3-PENTENIC ACID ESTERS BY CARBONYLATION OF ALKOXYBUTENES | BASF AKTIENGESELLSCHAFT (DE) | 1996-09-26 | — | — | WO | claimed |
| US-4843180-A | Preparation of ethers | THE DOW CHEMICAL COMPANY (US) | 1989-06-27 | — | — | US | claimed |
| US-4590300-A | Preparation of allylic compounds | THE DOW CHEMICAL COMPANY (US) | 1986-05-20 | — | — | US | claimed |
| US-11873308-B2 | Biologically active taxane analogs and methods of treatment by oral administration | TAPESTRY PHARMACEUTICALS, INC. (US) | 2024-01-16 | — | — | US | disclosed |
| US-20230348356-A1 | BUTYL-BRIDGED DIPHOSPHINE LIGANDS FOR ALKOXYCARBONYLATION | EVONIK OPERATIONS GMBH (DE) | 2023-11-02 | — | — | US | disclosed |
| US-11786504-B2 | Taxane analogs for the treatment of brain cancer | TAPESTRY PHARMACEUTICALS, INC. (US) | 2023-10-17 | — | — | US | disclosed |
| CN-113845545-A | Butyl-bridged diphosphine ligands for alkoxycarbonylation | 赢创运营有限公司 | 2021-12-28 | — | — | CN | disclosed |
| EP-2527420-B1 | LUBRICATING OIL COMPOSITION | JX NIPPON OIL & ENERGY CORP (JP) | 2021-09-29 | — | — | EP | disclosed |
| US-4675307-A | HYDROTALCITE | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1987-06-23 | — | — | US | disclosed |
| EP-0190352-A1 | ALKALI METAL-CARRYING SUBSTANCE, AND ITS USE AS CATALYST | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1986-08-13 | — | — | EP | disclosed |
| US-4590300-A | Preparation of allylic compounds | THE DOW CHEMICAL COMPANY (US) | 1986-05-20 | — | — | US | disclosed |
| US-4269750-A | Process for the preparation of polymers containing hydantoin groups | BAYER AKTIENGESELLSCHAFT (DE) | 1981-05-26 | — | — | US | disclosed |
| US-4246393-A | FROM AN UNSATURATED DICARBOXYLIC ACID AND AN ISOCYANATE OR ISOTHIOCYANATE HAVING TWO OR MORE ISOCYANATE OR ISOTHIOCYANATE GROUPS | BAYER AKTIENGESELLSCHAFT (DE) | 1981-01-20 | — | — | US | disclosed |