⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26931318 | 0.80 | PGK1 (0.34) | — | |
| SCHEMBL31501963 | 0.80 | TSHR (0.39) | — | |
| SCHEMBL27215794 | 0.74 | PGK1 (0.31) | — | |
| SCHEMBL29216784 | 0.73 | LPAR2 (0.33) | — | |
| SCHEMBL15209178 | 0.72 | — | — | |
| SCHEMBL27456047 | 0.72 | BTN3A1 (0.35) | — | |
| Dimethylamine SCHEMBL16714000 | 0.72 | PLA2G2A (0.32) | — | |
| SCHEMBL4260700 | 0.72 | — | — | |
| SCHEMBL27556697 | 0.72 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL11804868 | 0.72 | TDP1 (0.39) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0390216-B1 | Metallic pigment composition and water borne coating composition thereof | NIPPON PAINT CO LTD (JP) | 1994-01-12 | — | — | EP | disclosed |
| US-5057156-A | Containing phosphorous compound | NIPPON PAINT CO., LTD. (JP) | 1991-10-15 | — | — | US | disclosed |
| EP-0390216-A2 | Metallic pigment composition and water borne coating composition thereof | NIPPON PAINT CO., LTD. (JP) | 1990-10-03 | — | — | EP | disclosed |