⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6308167 | 0.97 | — | — | |
| Water SCHEMBL2842215 | 0.94 | — | — | |
| SCHEMBL28193329 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL28193874 | 0.71 | — | — | |
| SCHEMBL8163324 | 0.69 | MEN1 (0.35) | — | |
| SCHEMBL926283 | 0.69 | — | — | |
| Water SCHEMBL10786849 | 0.69 | — | — | |
| Ammonia Solution, Strong SCHEMBL28387451 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL749078 | 0.67 | — | — | |
| Water SCHEMBL4820615 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103961750-B | A kind of small-bore original position engineering blood vessel and construction method | LOGISTICS COLLEGE OF CHINESE ARMED POLICE FORCE (CN) | 2015-12-09 | — | — | CN | disclosed |