⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL669688 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL670105 | 0.97 | OPRM1 (0.32) | — | |
| Fluoride SCHEMBL22437511 | 0.97 | OPRM1 (0.32) | — | |
| Water SCHEMBL29118753 | 0.97 | OPRM1 (0.32) | — | |
| SCHEMBL3312745 | 0.82 | OPRM1 (0.42) | — | |
| Hydrochloric Acid SCHEMBL22749308 | 0.80 | OPRM1 (0.40) | — | |
| Hydrochloric Acid SCHEMBL22749309 | 0.80 | OPRM1 (0.40) | — | |
| SCHEMBL1236943 | 0.80 | OPRM1 (0.52) | — | |
| SCHEMBL10935578 | 0.79 | — | — | |
| SCHEMBL1752088 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8349860-B2 | Inhibitors of syk and JAK protein kinases | PORTOLA PHARMACEUTICALS, INC. (US) | 2013-01-08 | — | — | US | disclosed |
| US-8318755-B2 | Inhibitors of SYK and JAK protein kinases | PORTOLA PHARMACEUTICALS, INC. (US) | 2012-11-27 | — | — | US | disclosed |
| US-20120130073-A1 | INHIBITORS OF SYK AND JAK PROTEIN KINASES | PORTOLA PHARMACEUTICALS, INC. (US) | 2012-05-24 | — | — | US | disclosed |
| US-20120101275-A1 | INHIBITORS OF SYK AND JAK PROTEIN KINASES | PORTOLA PHARMACEUTICALS, INC. (US) | 2012-04-26 | — | — | US | disclosed |