⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8076018 | 0.83 | — | — | |
| SCHEMBL15791399 | 0.82 | — | — | |
| SCHEMBL12180911 | 0.77 | — | — | |
| SCHEMBL4671656 | 0.76 | NISCH (0.41) | — | |
| SCHEMBL8532162 | 0.76 | — | — | |
| SCHEMBL15630267 | 0.74 | — | — | |
| SCHEMBL14654530 | 0.74 | — | — | |
| SCHEMBL6206426 | 0.73 | BUB1 (0.32) | — | |
| SCHEMBL2307927 | 0.73 | HTR2A (0.43) | — | |
| SCHEMBL19593972 | 0.71 | HSD17B10 (0.30) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0502733-B1 | Air-activatable polymerisable compositions | LOCTITE IRELAND LTD (IE) | 1997-09-10 | — | — | EP | claimed |
| EP-0502733-A1 | Air-activatable polymerisable compositions | LOCTITE (IRELAND) Ltd. (IE) | 1992-09-09 | — | — | EP | claimed |
| US-5683536-A | PEROXIDE-FREE AUTOOXIDIZABLE FREE RADICAL CATALYST | LOCTITE LTD. (IE) | 1997-11-04 | — | — | US | disclosed |
| US-5523347-A | CONTAINS PARTIALLY HYDROGENATED PYRIDINES, CONDENSATION PRODUCT OF CYCLIC KETONES AND UREAS, SCHIFF'S BASE, INDOLES, PYRROLES, IMIDAZOLES, PIPERAZINES, CARBAZOLES AND TETRAHYDROQUNOLINES AS ACTIVATOR | LOCTITE (IRELAND) LIMITED (IE) | 1996-06-04 | — | — | US | disclosed |
| EP-0502733-A1 | Air-activatable polymerisable compositions | LOCTITE (IRELAND) Ltd. (IE) | 1992-09-09 | — | — | EP | disclosed |