⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7564486 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL7766517 | 0.97 | — | — | |
| SCHEMBL8169214 | 0.85 | — | — | |
| SCHEMBL18281068 | 0.71 | TLR8 (0.31) | — | |
| SCHEMBL8220098 | 0.70 | — | — | |
| SCHEMBL8157165 | 0.69 | — | — | |
| SCHEMBL17836857 | 0.69 | — | — | |
| SCHEMBL6438664 | 0.69 | MEN1 (0.39) | — | |
| SCHEMBL7768024 | 0.69 | HDAC3 (0.33) | — | |
| Hydrochloric Acid SCHEMBL17836036 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1104429-B1 | ANSA GROUP-4-METAL BIS (.MU.-SUBSTITUTED) ALUMINUM COMPLEXES | DOW CHEMICAL CO (US) | 2002-05-08 | — | — | EP | disclosed |
| EP-1104429-A1 | ANSA GROUP-4-METAL BIS (.MU.-SUBSTITUTED) ALUMINUM COMPLEXES | THE DOW CHEMICAL COMPANY (US) | 2001-06-06 | — | — | EP | disclosed |
| US-6140521-A | CONTACTING A CHARGE-NEUTRAL GROUP IV METAL COORDINATION COMPLEX HAVING AT LEAST TWO LEWIS BASIC GROUPS WITH A CHARGE-NEUTRAL ALUMINUM COORDINATION COMPLEXES HAVING LEWIS ACIDIC ALUMINUM ATOMS; OLEFIN POLYMERIZATION CATALYST | THE DOW CHEMICAL COMPANY (US) | 2000-10-31 | — | — | US | disclosed |
| WO-2000009523-A1 | ANSA-GROUP-4-METAL BIS (.MU.-SUBSTITUTED) ALUMINUM COMPLEXES | THE DOW CHEMICAL COMPANY (US) | 2000-02-24 | — | — | WO | disclosed |