⚠ 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 SCHEMBL28610204 | 1.00 | — | — | |
| SCHEMBL29601 | 0.94 | — | — | |
| Methane SCHEMBL16463501 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL11432293 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL11037230 | 0.89 | — | — | |
| SCHEMBL31429596 | 0.89 | — | — | |
| Ethylene SCHEMBL27984056 | 0.84 | — | — | |
| SCHEMBL1776917 | 0.82 | — | — | |
| Phosphoramidic Acid SCHEMBL1425025 | 0.80 | CA2 (0.36) | — | |
| Hydrochloric Acid SCHEMBL11428331 | 0.78 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3957928-A | S-AMMONIUM-O-HYDROCARBYL-N-ACYL PHOSPHORAMIDOTHIOATE SALT PRODUCTION AND REACTION WITH ALKYLATING AGENT | CHEVRON RESEARCH COMPANY (US) | 1976-05-18 | — | — | US | disclosed |