⚠ 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 | |
|---|---|---|---|---|
| Acetonitrile SCHEMBL8106401 | 1.00 | — | — | |
| Acetonitrile SCHEMBL10594717 | 1.00 | — | — | |
| Acetonitrile SCHEMBL27602399 | 0.96 | — | — | |
| Acetonitrile SCHEMBL28012599 | 0.96 | — | — | |
| Acetonitrile SCHEMBL586 | 0.95 | — | — | |
| Acetonitrile SCHEMBL2259244 | 0.95 | — | — | |
| Acetonitrile SCHEMBL15051448 | 0.95 | — | — | |
| Acetonitrile SCHEMBL8467273 | 0.95 | — | — | |
| Acetonitrile SCHEMBL27566580 | 0.92 | — | — | |
| Acetonitrile SCHEMBL2812301 | 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 63 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11891707-B2 | Method for making a PD-coated electrode | KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) | 2024-02-06 | — | — | US | claimed |
| US-20230099981-A1 | METHOD FOR MAKING A PV-COATED ELECTRODE | KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) | 2023-03-30 | — | — | US | claimed |
| US-20200370189-A1 | PD-COMPRISING ELECTROCATALYSTS SUITABLE FOR WATER SPLITTING | KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) | 2020-11-26 | — | — | US | claimed |
| US-12344569-B2 | Process for making a conjugated diene from an allyl alcohol | GIVAUDAN SA (CH) | 2025-07-01 | — | — | US | disclosed |
| EP-4168383-B1 | PROCESS FOR MAKING A CONJUGATED DIENE FROM AN ALLYL ALCOHOL | GIVAUDAN SA (CH) | 2024-07-31 | — | — | EP | disclosed |
| US-11891707-B2 | Method for making a PD-coated electrode | KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) | 2024-02-06 | — | — | US | disclosed |
| US-20230322645-A1 | PROCESS FOR MAKING A CONJUGATED DIENE FROM AN ALLYL ALCOHOL | GIVAUDAN SA (CH) | 2023-10-12 | — | — | US | disclosed |
| EP-4168383-A1 | PROCESS FOR MAKING A CONJUGATED DIENE FROM AN ALLYL ALCOHOL | Givaudan SA (CH) | 2023-04-26 | — | — | EP | disclosed |
| US-20230099981-A1 | METHOD FOR MAKING A PV-COATED ELECTRODE | KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) | 2023-03-30 | — | — | US | disclosed |
| US-11591701-B2 | Pd-comprising electrocatalysts suitable for water splitting | KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) | 2023-02-28 | — | — | US | disclosed |
| WO-2021255052-A1 | PROCESS FOR MAKING A CONJUGATED DIENE FROM AN ALLYL ALCOHOL | GIVAUDAN SA (CH) | 2021-12-23 | — | — | WO | disclosed |
| US-4730080-A | Process for the preparation of diesters of alkanedioic acids | SHELL OIL COMPANY (US) | 1988-03-08 | — | — | US | disclosed |
| US-4692548-A | DIMERIZATION OF ETHYLENICALLY UNSATURATED COMPOUNDS | SHELL OIL COMPANY (US) | 1987-09-08 | — | — | US | disclosed |
| EP-0231044-A2 | Process for the preparation of a diester of a dicarboxylic acid | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1987-08-05 | — | — | EP | disclosed |
| EP-0212729-A2 | Process for the preparation of diesters of alkanedioic acids | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1987-03-04 | — | — | EP | disclosed |
| US-4642371-A | Process for the preparation of diesters of dicarboxylic acids | SHELL OIL COMPANY (US) | 1987-02-10 | — | — | US | disclosed |
| EP-0206367-A2 | Process for the dimerization of ethylenically unsaturated compounds | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1986-12-30 | — | — | EP | disclosed |
| EP-0206366-A2 | Process for the preparation of diesters of dicarboxylic acids | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1986-12-30 | — | — | EP | disclosed |
| US-4599476-A | PALLADIUM OR RUTHENIUM CATALYST | SHELL OIL COMPANY (US) | 1986-07-08 | — | — | US | disclosed |
| EP-0170311-A2 | Process for the dimerization of olefins | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1986-02-05 | — | — | EP | disclosed |