⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10108564 | 0.79 | — | — | |
| SCHEMBL10108286 | 0.76 | — | — | |
| SCHEMBL10108565 | 0.74 | — | — | |
| SCHEMBL10102722 | 0.68 | MAPT (0.36) | — | |
| SCHEMBL10108327 | 0.64 | APOBEC3A (0.32) | — | |
| SCHEMBL10108563 | 0.61 | PSMB8 (0.31) | — | |
| SCHEMBL10108551 | 0.61 | — | — | |
| SCHEMBL10108566 | 0.60 | — | — | |
| SCHEMBL23213937 | 0.56 | NPSR1 (0.44) | — | |
| SCHEMBL11982601 | 0.56 | PSMB8 (0.30) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120202832-A1 | KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY | AUCKLAND UNISERVICES LIMITED (NZ) | 2012-08-09 | — | — | US | disclosed |
| US-20120077811-A1 | PRODRUG FORMS OF KINASE INHIBITORS AND THEIR USE IN THERAPY | AUCKLAND UNISERVICES LIMITED (NZ) | 2012-03-29 | — | — | US | disclosed |