⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL587919 | 0.96 | — | — | |
| SCHEMBL9591980 | 0.92 | — | — | |
| Ammonia Solution, Strong SCHEMBL11774648 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL11246727 | 0.92 | — | — | |
| SCHEMBL11841007 | 0.92 | — | — | |
| SCHEMBL9241704 | 0.86 | CA2 (0.35) | — | |
| SCHEMBL24835628 | 0.76 | — | — | |
| SCHEMBL15935826 | 0.72 | — | — | |
| SCHEMBL11621620 | 0.72 | — | — | |
| SCHEMBL14639800 | 0.72 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109651432-A | It is a kind of to prepare O, the method for O- dimethyl-S- (N- methylcarbamoyl methyl) thiophosphate | 河南省化工研究所有限责任公司 | 2019-04-19 | — | — | CN | claimed |
| CN-109651432-A | It is a kind of to prepare O, the method for O- dimethyl-S- (N- methylcarbamoyl methyl) thiophosphate | 河南省化工研究所有限责任公司 | 2019-04-19 | — | — | CN | disclosed |