⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10356513 | 0.62 | — | — | |
| SCHEMBL10937007 | 0.59 | — | — | |
| SCHEMBL22675788 | 0.59 | — | — | |
| SCHEMBL19751002 | 0.59 | — | — | |
| SCHEMBL7158413 | 0.58 | — | — | |
| SCHEMBL11430922 | 0.56 | — | — | |
| SCHEMBL21318455 | 0.56 | — | — | |
| SCHEMBL20982310 | 0.56 | — | — | |
| Methylsulfanylmethane SCHEMBL1330443 | 0.53 | — | — | |
| Methylsulfanylmethane SCHEMBL1618 | 0.53 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2188548-A | — | — | None | — | — | JP | disclosed |
| JP-61194756-A | — | — | None | — | — | JP | disclosed |
| JP-H02188548-A | PRODUCTION OF SATURATED ALDEHYDES BY HYDROGENATION OF ALPHA,BETA-UNSATURATED ALDEHYDES | RHONE POULENC SANTE | 1990-07-24 | — | — | JP | disclosed |
| JP-S61194756-A | RESIN SEAL TYPE SEMICONDUCTOR DEVICE | TOSHIBA CHEM CORP | 1986-08-29 | — | — | JP | disclosed |
| US-4366103-A | TRIALKYL PHOSPHOROTRITHIOITES, ALIPHATIC OR CYCLOALIPHATIC KETONES | RHONE-POULENC AGROCHIMIE (FR) | 1982-12-28 | — | — | US | disclosed |
| US-4096149-A | TO AMIDES; CATALYST COMPRISING THE REACTION PRODUCT OF A RHODIUM COMPOUND AND A THIOPHOSPHITE | NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) | 1978-06-20 | — | — | US | disclosed |
| US-3980661-A | Hydrolysis of nitriles | NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) | 1976-09-14 | — | — | US | disclosed |