⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11600319 | 0.70 | — | — | |
| SCHEMBL2820032 | 0.67 | — | — | |
| SCHEMBL27816782 | 0.59 | — | — | |
| SCHEMBL512396 | 0.59 | — | — | |
| SCHEMBL217259 | 0.59 | — | — | |
| SCHEMBL11259895 | 0.56 | — | — | |
| SCHEMBL351938 | 0.56 | — | — | |
| SCHEMBL2199 | 0.56 | — | — | |
| Isobutane SCHEMBL429587 | 0.54 | ALDH1A1 (0.50) | — | |
| Isopropyl Alcohol SCHEMBL385 | 0.54 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6956127-B2 | Alkyl group VA metal compounds | SHIPLEY COMPANY, L.L.C. (US) | 2005-10-18 | — | — | US | disclosed |
| US-6939983-B2 | Alkyl group VA metal compounds | ROHM AND HAAS ELECTRONIC MATERIALS, LLC (US) | 2005-09-06 | — | — | US | disclosed |
| US-20050033073-A1 | Alkyl group VA metal compounds | ROHM AND HAAS ELECTRONIC MATERIALS, L.L.C. (US) | 2005-02-10 | — | — | US | disclosed |
| US-20030199704-A1 | Alkyl group VA metal compounds | SHIPLEY COMPANY, L.L.C. (US) | 2003-10-23 | — | — | US | disclosed |
| US-20030181746-A1 | Alkyl Group VA metal compounds | SHIPLEY COMPANY, L.L.C. (US) | 2003-09-25 | — | — | US | disclosed |
| EP-1335416-A1 | Preparation of monoalkyl group 15 metal dihalides and dihydrides | Shipley Co. L.L.C. (US) | 2003-08-13 | — | — | EP | disclosed |
| US-RE29523-E | Olefinic polymers stabilized with thioacyl trivalent phosphorus compounds | BORG-WARNER CORPORATION (US) | 1978-01-24 | — | — | US | disclosed |