⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4591293 | 0.91 | — | — | |
| SCHEMBL4711832 | 0.75 | TTK (0.35) | — | |
| SCHEMBL8852658 | 0.71 | — | — | |
| SCHEMBL12152095 | 0.71 | — | — | |
| SCHEMBL18474994 | 0.69 | ALDH1A1 (0.34) | — | |
| SCHEMBL11753866 | 0.68 | — | — | |
| SCHEMBL8961504 | 0.68 | TTK (0.31) | — | |
| SCHEMBL3363136 | 0.67 | LMNA (0.32) | — | |
| SCHEMBL11546864 | 0.65 | — | — | |
| SCHEMBL27796709 | 0.65 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108069979-A | A kind of preparation method of bicyclic alkene tetracarboxylic dianhydride | 青岛科技大学 | 2018-05-25 | — | — | CN | disclosed |
| US-9218915-B2 | Non-aqueous electrolyte for lithium-ion battery | UCHICAGO ARGONNE, LLC (US) | 2015-12-22 | — | — | US | disclosed |
| US-20140186721-A1 | NON-AQUEOUS ELECTROLYTE FOR LITHIUM-ION BATTERY | UCHICAGO ARGONNE, LLC (US) | 2014-07-03 | — | — | US | disclosed |
| EP-2139857-A1 | SUB-TYPE SELECTIVE AZABICYCLOALKANE DERIVATIVES | Targacept Inc. (US) | 2010-01-06 | — | — | EP | disclosed |
| WO-2008121686-A1 | SUB-TYPE SELECTIVE AZABICYCLOALKANE DERIVATIVES | TARGACEPT, INC. (US) | 2008-10-09 | — | — | WO | disclosed |