⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5584285 | 1.00 | — | — | |
| Nanofin SCHEMBL6561177 | 0.91 | CYP2C9 (0.36) | — | |
| SCHEMBL6560852 | 0.73 | PHGDH (0.31) | — | |
| SCHEMBL9171843 | 0.72 | — | — | |
| SCHEMBL5584096 | 0.69 | PEPD (0.31) | — | |
| SCHEMBL5584140 | 0.68 | — | — | |
| SCHEMBL5584404 | 0.68 | PEPD (0.30) | — | |
| SCHEMBL137670 | 0.68 | KMT2A (0.32) | — | |
| SCHEMBL9169193 | 0.65 | — | — | |
| SCHEMBL17600642 | 0.64 | ACHE (0.33) | — |
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-20070039732-A1 | Methods and compositions for improving hydrocarbon recovery by water flood intervention | BJ SERVICES COMPANY | 2007-02-22 | — | — | US | disclosed |
| EP-0926164-B1 | Substituted amino silane compounds and catalyst for the polymerization of alpha-olefins containing them | BASELL NORTH AMERICA INC (US) | 2004-02-25 | — | — | EP | disclosed |
| US-6130180-A | Catalyst for the polymerization of alpha-olefins containing substituted amino silane compounds | MONTELL NORTH AMERICA INC. (US) | 2000-10-10 | — | — | US | disclosed |
| EP-0926164-A2 | Substituted amino silane compounds and catalyst for the polymerization of alpha-olefins containing them | MONTELL NORTH AMERICA INC. (US) | 1999-06-30 | — | — | EP | disclosed |