⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8853659 | 0.99 | — | — | |
| SCHEMBL8853965 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL8853526 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL8853552 | 0.84 | — | — | |
| SCHEMBL5342471 | 0.67 | FDPS (0.33) | — | |
| SCHEMBL5346798 | 0.67 | FDPS (0.33) | — | |
| SCHEMBL7166325 | 0.67 | FDPS (0.33) | — | |
| SCHEMBL6361185 | 0.66 | — | — | |
| SCHEMBL8951815 | 0.66 | FDPS (0.32) | — | |
| Hydrochloric Acid SCHEMBL6361681 | 0.65 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5700750-A | Process for polymerization of alpha-olefins | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1997-12-23 | — | — | US | disclosed |
| US-5604170-A | EFFECTIVE CATALYST SUPPORT SATISFYING CERTAIN REQUISITES: PARTICLE DIAMETER, SPECIFIC SURFACE AREA, PORE VOLUME, SPECIFIC GRAVITY; SUBJECTED TO ULTRASONIC DISINTEGRATION | NIPPON OIL COMPANY, LIMITED (JP) | 1997-02-18 | — | — | US | disclosed |