⚠ 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 SCHEMBL23160902 | 0.99 | — | — | |
| Hydrochloric Acid SCHEMBL284775 | 0.75 | — | — | |
| SCHEMBL7547347 | 0.75 | — | — | |
| SCHEMBL8612291 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL6294314 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL6295905 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL23160896 | 0.72 | — | — | |
| SCHEMBL8854187 | 0.67 | KDM4E (0.36) | — | |
| Hydrochloric Acid SCHEMBL7196705 | 0.66 | KDM4E (0.36) | — | |
| SCHEMBL819339 | 0.66 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8143430-B2 | Nano-linked heteronuclear metallocene catalyst compositions and their polymer products | CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) | 2012-03-27 | — | — | US | disclosed |
| US-8013177-B2 | Method and system for forming a precursor compound for non-bridged unsymmetric polyolefin polymerization catalyst | CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) | 2011-09-06 | — | — | US | disclosed |
| US-20100292425-A1 | METHOD AND SYSTEM FOR FORMING A PRECURSOR COMPOUND FOR NON-BRIDGED UNSYMMETRIC POLYOLEFIN POLYMERIZATION CATALYST | CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) | 2010-11-18 | — | — | US | disclosed |