Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9868594 | 0.92 | BACE1 (0.30) | BACE1 | |
| SCHEMBL9866772 | 0.83 | HTR4 (0.30) | TSHR | |
| SCHEMBL10810641 | 0.79 | CA2 (0.32) | BACE1 | |
| SCHEMBL27376799 | 0.78 | — | — | |
| SCHEMBL10424728 | 0.77 | BACE1 (0.34) | BACE1 | |
| Hydrochloric Acid SCHEMBL7264982 | 0.76 | BACE1 (0.34) | BACE1 | |
| SCHEMBL9869750 | 0.76 | HTR4 (0.30) | — | |
| SCHEMBL9822959 | 0.75 | DRD2 (0.30) | — | |
| Hydrochloric Acid SCHEMBL9406910 | 0.75 | HTR3A (0.45) | — | |
| SCHEMBL9866604 | 0.75 | DRD2 (0.31) | BACE1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5006570-A | Dihydrobenzofuran- and chroman-carboxamide derivatives, processes for the preparation thereof and use thereof as neuroleptics | LABORATOIRES DELAGRANGE (FR) | 1991-04-09 | — | — | US | disclosed |