⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7202513 | 0.82 | PDCD1 (0.33) | — | |
| SCHEMBL8897627 | 0.81 | ESR2 (0.30) | — | |
| SCHEMBL690034 | 0.75 | ESR2 (0.30) | — | |
| SCHEMBL27670351 | 0.70 | ESR2 (0.33) | — | |
| SCHEMBL691283 | 0.67 | — | — | |
| SCHEMBL7205026 | 0.66 | ESR2 (0.32) | — | |
| SCHEMBL7209110 | 0.66 | PDCD1 (0.35) | — | |
| SCHEMBL3672617 | 0.66 | BRD4 (0.32) | — | |
| SCHEMBL690449 | 0.65 | — | — | |
| SCHEMBL690035 | 0.65 | ESR2 (0.31) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0775148-B2 | BISCYCLOPENTADIENYL DIENE COMPLEXES | DOW CHEMICAL CO (US) | 2003-01-02 | — | — | EP | claimed |
| US-5972822-A | Biscyclopentadienyldiene complex containing addition polymerization catalysts | THE DOW CHEMICAL COMPANY (US) | 1999-10-26 | — | — | US | claimed |
| EP-0775148-B1 | BISCYCLOPENTADIENYL DIENE COMPLEXES | DOW CHEMICAL CO (US) | 1999-08-25 | — | — | EP | claimed |
| EP-0775148-A1 | BISCYCLOPENTADIENYL DIENE COMPLEXES | THE DOW CHEMICAL COMPANY (US) | 1997-05-28 | — | — | EP | claimed |
| US-5616664-A | Polymerization process with biscyclopentadienyl diene complex containing catalysts | THE DOW CHEMICAL COMPANY (US) | 1997-04-01 | — | — | US | claimed |
| WO-1996004290-A1 | BISCYCLOPENTADIENYL DIENE COMPLEXES | THE DOW CHEMICAL COMPANY (US) | 1996-02-15 | — | — | WO | claimed |
| EP-0775148-B2 | BISCYCLOPENTADIENYL DIENE COMPLEXES | DOW CHEMICAL CO (US) | 2003-01-02 | — | — | EP | disclosed |
| EP-0775148-B1 | BISCYCLOPENTADIENYL DIENE COMPLEXES | DOW CHEMICAL CO (US) | 1999-08-25 | — | — | EP | disclosed |
| EP-0915098-A2 | Biscyclopentadienyl diene complexes, their preparation and catalyst compositions containing them | THE DOW CHEMICAL COMPANY (US) | 1999-05-12 | — | — | EP | disclosed |