⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6280458 | 1.00 | — | — | |
| SCHEMBL8157485 | 0.75 | NFKB1 (0.33) | — | |
| SCHEMBL7060797 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL7197097 | 0.69 | NFKB1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL12815602 | 0.69 | NFKB1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL4067791 | 0.69 | NFKB1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL7197100 | 0.69 | NFKB1 (0.30) | — | |
| SCHEMBL22236875 | 0.67 | — | — | |
| SCHEMBL9999342 | 0.67 | — | — | |
| SCHEMBL19827874 | 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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111500222-A | Light switch curing type polyisobutylene adhesive composition and sizing process thereof | 郝建强 | 2020-08-07 | — | — | CN | claimed |
| CN-101341176-A | Ethylene polymer, catalyst for producing ethylene polymer, and method for producing ethylene polymer | TOSOH CORP (JP) | 2009-01-07 | — | — | CN | disclosed |
| EP-0963382-B2 | POLYMERIZATION CATALYST SYSTEMS COMPRISING HETEROCYCLIC FUSED CYCLOPENTADIENIDE LIGANDS | EXXONMOBIL CHEM PATENTS INC (US) | 2008-07-02 | — | — | EP | disclosed |
| US-6451938-B1 | CATALYTIC COMPLEX FORMED BY ACTIVATING TRANSITION METAL COMPOUNDS COMPRISING CYCLOPENTADIENIDE ANIONS WHICH BEAR FUSED HETEROCYCLIC RINGS | EXXON MOBIL CHEMICAL PATENTS INC. | 2002-09-17 | — | — | US | disclosed |
| EP-0963382-B1 | POLYMERIZATION CATALYST SYSTEMS COMPRISING HETEROCYCLIC FUSED CYCLOPENTADIENIDE LIGANDS | EXXONMOBIL CHEM PATENTS INC (US) | 2001-11-14 | — | — | EP | disclosed |
| EP-0963382-A1 | POLYMERIZATION CATALYST SYSTEMS COMPRISING HETEROCYCLIC FUSED CYCLOPENTADIENIDE LIGANDS | EXXON CHEMICAL PATENTS INC. (US) | 1999-12-15 | — | — | EP | disclosed |
| EP-0902793-A1 | MODIFIED POLYSILOXANE CATALYSTS AND A METHOD OF USING THE SAME | Lyondell Petrochemical Company (US) | 1999-03-24 | — | — | EP | disclosed |
| WO-1998037106-A1 | POLYMERIZATION CATALYST SYSTEMS COMPRISING HETEROCYCLIC FUSED CYCLOPENTADIENIDE LIGANDS | EXXON CHEMICAL PATENTS INC. (US) | 1998-08-27 | — | — | WO | disclosed |
| WO-1997045459-A1 | MODIFIED POLYSILOXANE CATALYSTS AND A METHOD OF USING THE SAME | LYONDELL PETROCHEMICAL COMPANY (US) | 1997-12-04 | — | — | WO | disclosed |