⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6441179 | 0.85 | PKM (0.31) | — | |
| Methylamine SCHEMBL3687155 | 0.84 | — | — | |
| Isopropyl Alcohol SCHEMBL6142886 | 0.82 | ALDH1A1 (0.35) | — | |
| Isopropyl Alcohol SCHEMBL28931811 | 0.82 | ALDH1A1 (0.35) | — | |
| SCHEMBL8591536 | 0.80 | — | — | |
| SCHEMBL22478 | 0.80 | — | — | |
| Isopropyl Alcohol SCHEMBL1452102 | 0.80 | ALDH1A1 (0.33) | — | |
| SCHEMBL6064746 | 0.78 | — | — | |
| SCHEMBL216579 | 0.78 | — | — | |
| SCHEMBL21367528 | 0.78 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9862736-B2 | Bimetallic complex comprising cyclopentadienyl and amidine ligands | ARLANXEO NETHERLANDS B.V. (NL) | 2018-01-09 | — | — | US | disclosed |
| US-20160122370-A1 | BIMETALLIC COMPLEX COMPRISING CYCLOPENTADIENYL AND AMIDINE LIGANDS | ARLANXEO NETHERLANDS B.V. (NL) | 2016-05-05 | — | — | US | disclosed |
| EP-0505997-B1 | Process for producing styrenic polymer and copolymer | IDEMITSU KOSAN CO (JP) | 1997-05-28 | — | — | EP | disclosed |
| EP-0490269-B1 | Graft copolymer and process for producing the same | IDEMITSU KOSAN CO (JP) | 1996-02-28 | — | — | EP | disclosed |
| US-5378777-A | Styrene monomer substituted with silicon group, transition metal complex catalyst | IDEMITSU KOSAN CO., LTD. (JP) | 1995-01-03 | — | — | US | disclosed |
| US-5250629-A | Graft polymerization of styrene and ethylenically unsaturated monomer using transition metal catalysts, organoaluminum compounds; films, packaging, automobile parts | IDEMITSU KOSAN CO., LTD. (JP) | 1993-10-05 | — | — | US | disclosed |
| EP-0505997-A2 | Process for producing styrenic polymer and copolymer | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1992-09-30 | — | — | EP | disclosed |
| EP-0490269-A1 | Graft copolymer and process for producing the same | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1992-06-17 | — | — | EP | disclosed |