⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL165637 | 0.75 | — | — | |
| SCHEMBL5576194 | 0.75 | — | — | |
| SCHEMBL9780552 | 0.75 | — | — | |
| SCHEMBL2494019 | 0.75 | — | — | |
| SCHEMBL691714 | 0.75 | — | — | |
| SCHEMBL21051743 | 0.69 | — | — | |
| SCHEMBL14859786 | 0.67 | — | — | |
| SCHEMBL21051721 | 0.67 | — | — | |
| SCHEMBL4342910 | 0.67 | — | — | |
| SCHEMBL5072564 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2543437-A2 | HOMOGENEOUS ASYMMETRIC HYDROGENATION CATALYST | Takasago International Corporation (JP) | 2013-01-09 | — | — | EP | disclosed |
| US-20070269991-A1 | SEMICONDUCTOR NANOCRYSTAL-METAL COMPLEX AND METHOD OF PREPARING THE SAME | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2007-11-22 | — | — | US | disclosed |
| US-6331628-B1 | REACTING A SUBSTITUTED HALOBENZENE WITH POTASSIUM, SODIUM AND/OR ZINC CYANIDE IN THE PRESENCE OF A METALLIC CATALYST | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2001-12-18 | — | — | US | disclosed |
| US-5961890-A | ORGANOMETALLIC COMPLEXES OF (A) CR, MO OR W AND/OR (B) NI, PD OR PT; ESPECIALLY DIPHENYLPHOSPHINOPYRIDONATE COMPLEXES. | AGENCY OF INDUSTRIAL SCIENCE & TECHNOLOGY (JP) | 1999-10-05 | — | — | US | disclosed |