Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 4/20 | 0.51 |
| ▸ | SIRT2 | Q8IXJ6 | 3/20 | 0.47 |
| ▸ | QPCT | Q16769 | 1/20 | 0.46 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TYR | P14679 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29411661 | 0.77 | L3MBTL1 (0.47) | S1PR1SIRT2QPCTS1PR3NPC1 | |
| SCHEMBL21045507 | 0.77 | L3MBTL1 (0.47) | S1PR1SIRT2QPCTS1PR3NPC1 | |
| SCHEMBL19835591 | 0.72 | TDP1 (0.62) | SIRT2NPC1TSHRRAB9AHTT | |
| SCHEMBL19835734 | 0.72 | MAPK1 (0.44) | S1PR1SIRT2QPCTLMNAMAPT | |
| SCHEMBL3932295 | 0.70 | RAB9A (0.71) | S1PR1S1PR3NPC1TSHRRAB9A | |
| SCHEMBL24386291 | 0.69 | SIRT2 (0.55) | SIRT2NOTUMNPC1TSHRRAB9A | |
| SCHEMBL95543 | 0.69 | SMN1; SMN2 (0.69) | SIRT2NPC1TSHRRAB9AHTT | |
| SCHEMBL19835706 | 0.69 | SIRT2 (0.70) | S1PR1SIRT2S1PR3NPC1RAB9A | |
| SCHEMBL8415601 | 0.68 | SIRT2 (0.48) | S1PR1SIRT2NOTUMS1PR3NPC1 | |
| SCHEMBL2463860 | 0.68 | BRD4 (0.49) | S1PR1BRD4TYR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3275440-B1 | NOVEL OXADIAZOLE DERIVATIVE AND PHARMACEUTICAL CONTAINING SAME | NAT CT GERIATRICS & GERONTOLOGY (JP) | 2022-05-04 | — | — | EP | disclosed |
| EP-3275440-A1 | NOVEL OXADIAZOLE DERIVATIVE AND PHARMACEUTICAL CONTAINING SAME | National Center for Geriatrics and Gerontology (JP) | 2018-01-31 | — | — | EP | disclosed |