⚠ 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 | |
|---|---|---|---|---|
| Carbamic Acid SCHEMBL27652519 | 0.97 | — | — | |
| Carbamic Acid SCHEMBL27878774 | 0.95 | — | — | |
| Urea SCHEMBL28144398 | 0.92 | — | — | |
| Bicarbonate SCHEMBL27742283 | 0.89 | — | — | |
| Methyl Carbamate SCHEMBL27688023 | 0.88 | ALOX15 (0.31) | — | |
| Urethane SCHEMBL27403417 | 0.86 | ALOX15 (0.46) | — | |
| Propylamine SCHEMBL27970480 | 0.85 | — | — | |
| Ethylenediamine SCHEMBL27871639 | 0.85 | — | — | |
| Carbamic Acid SCHEMBL28778823 | 0.85 | — | — | |
| SCHEMBL27571842 | 0.85 | TDP1 (0.35) | — |
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-110051886-A | The medical device and method that antithrombotic generates | 柯惠有限合伙公司 | 2019-07-26 | — | — | CN | disclosed |
| CN-105744965-B | Antithrombotic medical devices and methods | 柯惠有限合伙公司 | 2019-07-09 | — | — | CN | disclosed |