⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27521133 | 0.74 | — | — | |
| SCHEMBL9650251 | 0.71 | — | — | |
| SCHEMBL24003167 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL22771549 | 0.69 | — | — | |
| SCHEMBL9776448 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL27735934 | 0.67 | — | — | |
| SCHEMBL7164277 | 0.67 | — | — | |
| SCHEMBL1274213 | 0.65 | — | — | |
| SCHEMBL19922276 | 0.65 | — | — | |
| SCHEMBL20523463 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0715637-B1 | SILICONE GRAFTED THERMOPLASTIC ELASTOMERIC COPOLYMERS AND HAIR AND SKIN CARE COMPOSITIONS CONTAINING THE SAME | PROCTER & GAMBLE (US) | 1999-10-13 | — | — | EP | claimed |
| US-5258357-A | Carboxamides, their preparation and their use as herbicides | BASF AKTIENGESELLSCHAFT (DE) | 1993-11-02 | — | — | US | disclosed |