Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL20177943 | 0.80 | HTR3A (0.36) | DRD2HTR3A | |
| SCHEMBL20177570 | 0.78 | PDE4A (0.31) | — | |
| SCHEMBL20177538 | 0.70 | — | — | |
| SCHEMBL20041973 | 0.70 | TSHR (0.39) | DRD2 | |
| SCHEMBL19559484 | 0.68 | TSHR (0.40) | DRD2 | |
| SCHEMBL16785342 | 0.68 | TSHR (0.40) | DRD2 | |
| SCHEMBL20177592 | 0.68 | ESRRG (0.34) | — | |
| SCHEMBL20177534 | 0.66 | RECQL (0.31) | — | |
| SCHEMBL20177577 | 0.65 | GPBAR1 (0.36) | — | |
| SCHEMBL19559451 | 0.62 | TSHR (0.43) | DRD2 |
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-2018092916-A1 | NITROGEN-CONTAINING POLYCYCLIC HETEROCYCLIC DERIVATIVE | 宇部興産株式会社 | 2018-05-24 | — | — | WO | disclosed |