⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9681822 | 1.00 | — | — | |
| SCHEMBL6109145 | 0.87 | CASP1 (0.30) | — | |
| SCHEMBL503842 | 0.80 | — | — | |
| SCHEMBL470368 | 0.80 | — | — | |
| SCHEMBL692346 | 0.80 | — | — | |
| SCHEMBL11762239 | 0.77 | — | — | |
| SCHEMBL11762237 | 0.77 | — | — | |
| SCHEMBL8052611 | 0.75 | — | — | |
| SCHEMBL1407388 | 0.75 | — | — | |
| SCHEMBL1407387 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5155240-A | Process for producing optically active dihydropyran derivative | TAKASAGO INTERNATIONAL CORPORATION (JP) | 1992-10-13 | — | — | US | disclosed |
| US-4288614-A | FROM 2-(ALKANOYLOXY)METHYL-3-METHYL-6- ALKOXY-3,6-DIHYDRO-2H-PYRANS; AMINE CATALYST | HOFFMANN-LA ROCHE INC. (US) | 1981-09-08 | — | — | US | disclosed |
| US-4225514-A | FROM A SUBSTITUTED PYRAN | HOFFMANN-LA ROCHE INC. (US) | 1980-09-30 | — | — | US | disclosed |
| US-4222943-A | CHEMICAL INTERMEDIATES | HOFFMANN-LA ROCHE INC. (US) | 1980-09-16 | — | — | US | disclosed |
| US-4152520-A | INTERMEDIATE FOR SYNTHESIS OF VITAMIN A | HOFFMANN-LA ROCHE INC. (US) | 1979-05-01 | — | — | US | disclosed |
| US-4071538-A | Pyran aldehydes | HOFFMANN-LA ROCHE INC. (US) | 1978-01-31 | — | — | US | disclosed |
| US-3997529-A | 2-(CYCLOHEXENYLALKENYL)-6-ALKOXY-3,6-DIHYDO-2H-PYRANS | HOFFMANN-LA ROCHE INC. (US) | 1976-12-14 | — | — | US | disclosed |