Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL166251 | 0.94 | — | — | |
| Bromide SCHEMBL28381138 | 0.88 | — | — | |
| SCHEMBL7787493 | 0.88 | ALDH1A1 (0.30) | — | |
| SCHEMBL28917443 | 0.88 | ALDH1A1 (0.30) | — | |
| SCHEMBL531269 | 0.88 | ALDH1A1 (0.30) | — | |
| SCHEMBL32664468 | 0.88 | ALDH1A1 (0.30) | — | |
| SCHEMBL32664729 | 0.88 | ALDH1A1 (0.30) | — | |
| SCHEMBL15939732 | 0.88 | ALDH1A1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL5918575 | 0.88 | — | — | |
| SCHEMBL6703426 | 0.80 | ALDH1A1 (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 |
|---|---|---|---|---|---|---|---|
| EP-0507574-B1 | Process for preparing polyolefins | NIPPON OIL CO LTD (JP) | 1996-12-27 | — | — | EP | disclosed |
| US-5541271-A | Process for preparing polyolefins | NIPPON OIL COMPANY, LIMITED (JP) | 1996-07-30 | — | — | US | disclosed |
| EP-0507574-A2 | Process for preparing polyolefins | NIPPON OIL COMPANY, LIMITED (JP) | 1992-10-07 | — | — | EP | disclosed |
| US-3962204-A | CATALYST OF TITANIUM OR VANADIUM COMPOUND, ORGANOMETALLICS | NIPPON OIL COMPANY LTD. (JA) | 1976-06-08 | — | — | US | disclosed |