⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9559788 | 0.83 | — | — | |
| SCHEMBL21708235 | 0.81 | — | — | |
| SCHEMBL10522453 | 0.81 | TSHR (0.34) | — | |
| SCHEMBL2382620 | 0.75 | — | — | |
| SCHEMBL28617279 | 0.75 | TSHR (0.36) | — | |
| SCHEMBL6740341 | 0.75 | TSHR (0.36) | — | |
| SCHEMBL11498533 | 0.74 | — | — | |
| SCHEMBL6439082 | 0.74 | — | — | |
| SCHEMBL13263355 | 0.74 | — | — | |
| SCHEMBL451420 | 0.73 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106715430-A | Inhibition of transient receptor potential A1 ion channels | 海德拉生物科学公司 | 2017-05-24 | — | — | CN | claimed |
| CN-102153562-B | Spiro-oxindole compounds and their uses as therapeutic agents | XENON PHARMACEUTICALS INC | 2015-05-13 | — | — | CN | claimed |
| EP-0191542-A1 | Arylcyclobutylalkyl amines and their use as antidepressive medicines | The Boots Company PLC (GB) | 1986-08-20 | — | — | EP | claimed |
| CN-106715430-B | inhibition of transient receptor potential A1 ion channels | 伊莱利利公司 | 2019-09-17 | — | — | CN | disclosed |
| CN-106715430-A | Inhibition of transient receptor potential A1 ion channels | 海德拉生物科学公司 | 2017-05-24 | — | — | CN | disclosed |
| EP-1819693-A1 | ANTITHROMBOTIC DIAMIDES | ELI LILLY AND COMPANY (US) | 2007-08-22 | — | — | EP | disclosed |
| WO-2006057868-A1 | ANTITHROMBOTIC DIAMIDES | ELI LILLY AND COMPANY (US) | 2006-06-01 | — | — | WO | disclosed |
| EP-0191542-A1 | Arylcyclobutylalkyl amines and their use as antidepressive medicines | The Boots Company PLC (GB) | 1986-08-20 | — | — | EP | disclosed |