⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27701156 | 0.72 | MAPT (0.31) | — | |
| SCHEMBL27721773 | 0.70 | RET (0.31) | — | |
| SCHEMBL27659878 | 0.68 | PARP1 (0.37) | — | |
| SCHEMBL29671172 | 0.68 | SYK (0.41) | — | |
| SCHEMBL22192 | 0.68 | SYK (0.41) | — | |
| SCHEMBL27721875 | 0.64 | MAPT (0.37) | — | |
| SCHEMBL28798263 | 0.63 | — | — | |
| SCHEMBL27735476 | 0.61 | ALDH1A1 (0.39) | — | |
| SCHEMBL27774969 | 0.61 | CNR2 (0.31) | — | |
| SCHEMBL13181118 | 0.61 | PARP1 (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-102491985-B | Synthesis method for 6-amino-2,2-dimethyl-2H-pyridino-[3,2-b] [1,4] oxazine-3(4H)-ketone | PHARMABLOCK NANJING R & D CO LTD | 2014-04-09 | — | — | CN | disclosed |
| CN-102491985-A | Synthesis method for 6-amino-2,2-dimethyl-2H-pyridino-[3,2-b] [1,4] oxazine-3(4H)-ketone | NANJING YAOSHI PHARMACEUTICAL RES DEV CO LTD | 2012-06-13 | — | — | CN | disclosed |