⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL133214 | 0.87 | DRD2 (0.30) | — | |
| SCHEMBL319659 | 0.86 | DRD2 (0.34) | — | |
| SCHEMBL318316 | 0.84 | — | — | |
| SCHEMBL305737 | 0.83 | DRD2 (0.31) | — | |
| SCHEMBL2679740 | 0.83 | — | — | |
| SCHEMBL3615951 | 0.82 | EPHX1 (0.31) | — | |
| SCHEMBL4920099 | 0.82 | DRD2 (0.31) | — | |
| SCHEMBL514446 | 0.81 | EPHX1 (0.33) | — | |
| SCHEMBL318768 | 0.81 | EPHX1 (0.33) | — | |
| SCHEMBL318176 | 0.81 | EPHX1 (0.33) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8252944-B2 | Process for preparing heteroaromatic ring compound having N-Rf group | DAIKIN INDUSTRIES, LTD. (JP) | 2012-08-28 | — | — | US | disclosed |
| US-8212053-B2 | Process for preparing heteroaromatic ring compound having N-Rf group | DAIKIN INDUSTRIES, LTD. (JP) | 2012-07-03 | — | — | US | disclosed |
| US-20120116097-A1 | PROCESS FOR PREPARING HETEROAROMATIC RING COMPOUND HAVING N-Rf GROUP | DAIKIN INDUSTRIES, LTD. (JP) | 2012-05-10 | — | — | US | disclosed |
| US-20100222598-A1 | PROCESS FOR PREPARING HETEROAROMATIC RING COMPOUND HAVING N-Rf GROUP | DAIKIN INDUSTRIES, LTD. (JP) | 2010-09-02 | — | — | US | disclosed |
| EP-1975157-A1 | METHOD FOR PRODUCTION OF HETEROAROMATIC RING COMPOUND HAVING N-Rf GROUP | Daikin Industries, Ltd. (JP) | 2008-10-01 | — | — | EP | disclosed |
| US-20050175867-A1 | Mixture of two or more organic salts; reduced melting point; low temperature stability; polymer electrolyte fuel cells, dye sensitized solar cells, biological batteries | DAIKIN INDUSTRIES, LTD (JP) | 2005-08-11 | — | — | US | disclosed |