⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3035551 | 0.92 | — | — | |
| SCHEMBL5320056 | 0.78 | ALDH1A1 (0.52) | — | |
| SCHEMBL4612524 | 0.77 | — | — | |
| SCHEMBL2513477 | 0.76 | ALDH1A1 (0.52) | — | |
| SCHEMBL8381260 | 0.76 | ALDH1A1 (0.52) | — | |
| SCHEMBL9419038 | 0.76 | ALDH1A1 (0.50) | — | |
| SCHEMBL49179 | 0.74 | — | — | |
| SCHEMBL774686 | 0.74 | — | — | |
| SCHEMBL757213 | 0.74 | — | — | |
| SCHEMBL177129 | 0.74 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-86106163-A | New henzodiozepanne and synthetic method thereof and the application on therapeutics | — | 1987-04-08 | — | — | CN | claimed |
| US-20160137779-A1 | CURABLE EPOXY RESIN COMPOSITION AND CURED PRODUCT THEREOF | DAICEL CORPORATION (JP) | 2016-05-19 | — | — | US | disclosed |
| US-20160122466-A1 | CURABLE EPOXY RESIN COMPOSITION AND CURED PRODUCT THEREOF, DIOLEFIN COMPOUND AND PRODUCTION METHOD THEREFOR, AND PRODUCTION METHOD FOR DIEPOXY COMPOUND | DAICEL CORPORATION (JP) | 2016-05-05 | — | — | US | disclosed |
| EP-2995632-A1 | CURABLE EPOXY RESIN COMPOSITION AND CURED PRODUCT THEREOF, DIOLEFIN COMPOUND AND PRODUCTION METHOD THEREFOR, AND PRODUCTION METHOD FOR DIEPOXY COMPOUND | Daicel Corporation (JP) | 2016-03-16 | — | — | EP | disclosed |
| EP-2995633-A1 | CURABLE EPOXY RESIN COMPOSITION AND CURED PRODUCT THEREOF | Daicel Corporation (JP) | 2016-03-16 | — | — | EP | disclosed |
| US-4268673-A | ANALGESICS | ACF CHEMIEFARMA N.V. (NL) | 1981-05-19 | — | — | US | disclosed |
| US-4246413-A | ANALGESICS, ANTITUSSIVE AGENT, AND NARCOTICS ANTAGONIST | BRISTOL-MYERS COMPANY (US) | 1981-01-20 | — | — | US | disclosed |
| US-4228285-A | ANALGESICS, NARCOTIC ANTAGONISTS, ANTITUSSIVES AND ADH INHIBITORS | BRISTOL-MYERS COMPANY (US) | 1980-10-14 | — | — | US | disclosed |
| US-4128548-A | Process for preparing 6,7-benzomorphans | ACF CHEMIEFARMA N.V. (NL) | 1978-12-05 | — | — | US | disclosed |
| US-4012392-A | ANALGESICS, MORPHINE ANTAGONISTS | ACF CHEMIEFARMA N.V. (NL) | 1977-03-15 | — | — | US | disclosed |
| US-3931272-A | Biodegradable detergents | UNIVERSAL OIL PRODUCTS COMPANY (US) | 1976-01-06 | — | — | US | disclosed |
| US-3931272-A | Biodegradable detergents | UNIVERSAL OIL PRODUCTS COMPANY (US) | 1976-01-06 | — | — | US | disclosed |
| US-3867432-A | Biodegradable sulfonate detergents | UNIVERSAL OIL PROD CO | 1975-02-18 | — | — | US | disclosed |