⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3944296 | 0.75 | — | — | |
| SCHEMBL8896709 | 0.75 | SLC22A6 (0.57) | — | |
| SCHEMBL28518010 | 0.75 | — | — | |
| SCHEMBL27821301 | 0.73 | — | — | |
| SCHEMBL27415072 | 0.73 | — | — | |
| SCHEMBL6277591 | 0.73 | — | — | |
| SCHEMBL28600525 | 0.73 | — | — | |
| SCHEMBL14890402 | 0.71 | — | — | |
| SCHEMBL8527696 | 0.71 | — | — | |
| Ethylene SCHEMBL8854273 | 0.71 | SLC22A6 (0.40) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20040197293-A1 | Anionic polyurethanes with elastic property | L'OREAL S.A. (FR) | 2004-10-07 | — | — | US | claimed |
| US-20040197293-A1 | Anionic polyurethanes with elastic property | L'OREAL S.A. (FR) | 2004-10-07 | — | — | US | disclosed |
| US-4929607-A | ANTITUMOR AGENTS | ASTA PHARMA AKTIENGESELLSHAFT | 1990-05-29 | — | — | US | disclosed |
| US-4623742-A | ANTITUMOR AGENTS, IMMUNOSUPPRESSANTS | ASTA-WERKE AKTIENGESELLSCHAFT CHEMISCHE FABRIK (DE) | 1986-11-18 | — | — | US | disclosed |