⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10466739 | 0.75 | PKM (0.32) | — | |
| SCHEMBL10467350 | 0.73 | TAS1R3 (0.33) | — | |
| SCHEMBL19891714 | 0.72 | CA1 (0.35) | — | |
| SCHEMBL10467349 | 0.71 | F2 (0.33) | — | |
| SCHEMBL10468809 | 0.71 | CA1 (0.33) | — | |
| SCHEMBL1683275 | 0.71 | F2 (0.54) | — | |
| SCHEMBL26812 | 0.70 | HTT (0.47) | — | |
| SCHEMBL10823807 | 0.70 | CA1 (0.43) | — | |
| SCHEMBL14805176 | 0.67 | CA12 (0.54) | — | |
| SCHEMBL19891667 | 0.67 | CA1 (0.38) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4897144-A | Foe silaceous material, metals, alloys, and epoxy reactive polymers | HERCULES INCORPORATED (US) | 1990-01-30 | — | — | US | disclosed |
| EP-0308860-A2 | A new epoxy-azide | HERCULES INCORPORATED (US) | 1989-03-29 | — | — | EP | disclosed |
| US-4772733-A | BONDING AGENT FOR POLYMER AND OTHER MATERIALS | HERCULES INCORPORATED (US) | 1988-09-20 | — | — | US | disclosed |