⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL1965549 | 1.00 | — | — | |
| SCHEMBL14392147 | 0.97 | — | — | |
| SCHEMBL58102 | 0.97 | — | — | |
| SCHEMBL16255540 | 0.97 | — | — | |
| SCHEMBL2174997 | 0.97 | GABRR1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL27370476 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL28285868 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL28313137 | 0.89 | OPRM1 (0.39) | — | |
| SCHEMBL27792259 | 0.86 | OPRM1 (0.40) | — | |
| Ammonia Solution, Strong SCHEMBL28313138 | 0.85 | — | — |
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-1226197-B1 | SPANDEX-FIBER POLYURETHANEUREA POLYMERS PREPARED USING 1,3-DIAMINOPENTANE AS CHAIN EXTENDER | DU PONT (US) | 2004-03-24 | — | — | EP | claimed |
| US-20170183444-A1 | CURING AGENTS FOR LOW-EMISSION EPOXY RESIN PRODUCTS | SIKA TECHNOLOGY AG (CH) | 2017-06-29 | — | — | US | disclosed |
| US-9631047-B2 | Curing agents for low-emission epoxy resin products | SIKA TECHNOLOGY AG (CH) | 2017-04-25 | — | — | US | disclosed |
| EP-2943519-B1 | HARDENERS FOR LOW-EMISSION EPOXY RESIN PRODUCTS | SIKA TECHNOLOGY AG (CH) | 2016-11-02 | — | — | EP | disclosed |
| US-20150337076-A1 | CURING AGENTS FOR LOW-EMISSION EXPOXY RESIN PRODUCTS | SIKA TECHNOLOGY AG (CH) | 2015-11-26 | — | — | US | disclosed |