⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4723749 | 0.88 | — | — | |
| SCHEMBL24282575 | 0.88 | — | — | |
| SCHEMBL4722164 | 0.85 | KDM4E (0.31) | — | |
| Hydrochloric Acid SCHEMBL30552228 | 0.83 | KDM4E (0.31) | — | |
| SCHEMBL3586396 | 0.81 | GNAI3 (0.31) | — | |
| SCHEMBL4724222 | 0.81 | SMN1; SMN2 (0.37) | — | |
| SCHEMBL4721850 | 0.81 | POLB (0.32) | — | |
| SCHEMBL22416469 | 0.79 | HTR1A (0.33) | — | |
| SCHEMBL24292438 | 0.75 | — | — | |
| SCHEMBL22416399 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019171277-A1 | CYLCOALKENYL DERIVATIVES USEFUL AS AGONISTS OF THE GPR120 AND /OR GPR40 RECEPTORS | JANSSEN PHARMACEUTICA NV (BE) | 2019-09-12 | — | — | WO | disclosed |