⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5689276 | 0.79 | LMNA (0.48) | — | |
| SCHEMBL7592220 | 0.76 | — | — | |
| SCHEMBL1665407 | 0.75 | — | — | |
| SCHEMBL1663118 | 0.75 | — | — | |
| SCHEMBL3348437 | 0.75 | — | — | |
| SCHEMBL15011424 | 0.74 | — | — | |
| SCHEMBL26324362 | 0.73 | GRIK1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL2979638 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL1367613 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL15561473 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-2009161518-A | WATER-SOLUBLE ANTIBACTERIAL COMPOSITION | NEOS CO LTD | 2009-07-23 | — | — | JP | disclosed |
| US-4816037-A | POLYHYDROXYHYDROCARBYLAMINES, FRICTION RESISTANCE | MOBIL OIL CORPORATION (US) | 1989-03-28 | — | — | US | disclosed |