⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8847287 | 0.74 | PTGS1 (0.32) | — | |
| SCHEMBL8847201 | 0.72 | PTGS1 (0.31) | — | |
| SCHEMBL8847162 | 0.71 | — | — | |
| SCHEMBL8847173 | 0.70 | PTGS1 (0.31) | — | |
| SCHEMBL8847164 | 0.68 | PTGS1 (0.31) | — | |
| SCHEMBL8847541 | 0.68 | — | — | |
| SCHEMBL8847307 | 0.66 | KCNH2 (0.43) | — | |
| SCHEMBL8847298 | 0.66 | PTGS2 (0.31) | — | |
| SCHEMBL8847343 | 0.63 | — | — | |
| SCHEMBL8847552 | 0.61 | LMNA (0.36) | — |
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-0603557-B1 | Catalyst compositions and catalytic processes | PHILLIPS PETROLEUM CO (US) | 1997-07-30 | — | — | EP | disclosed |
| US-5461126-A | Process of polymerizing olefins using organonickel catalyst compositions | PHILLIPS PETROLEUM COMPANY (US) | 1995-10-24 | — | — | US | disclosed |
| US-5332708-A | Ethylene polymerization catalyst, organonickel compound and a heterocyclic nitrogen compound | PHILLIPS PETROLEUM COMPANY (US) | 1994-07-26 | — | — | US | disclosed |
| EP-0603557-A1 | Catalyst compositions and catalytic processes | PHILLIPS PETROLEUM COMPANY (US) | 1994-06-29 | — | — | EP | disclosed |