Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | FPR3 | P25089 | 4/20 | 0.42 |
| ▸ | FPR2 | P25090 | 4/20 | 0.42 |
| ▸ | CTSK | P43235 | 3/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.39 |
| ▸ | AAK1 | Q2M2I8 | 4/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL9536355 | 0.87 | MEN1 (0.48) | MEN1GAAKMT2ACTSKCTSS | |
| SCHEMBL19331769 | 0.83 | FPR3 (0.47) | NPC1RECQLRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL2726076 | 0.81 | MEN1 (0.43) | NPC1RECQLRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL1141270 | 0.81 | MEN1 (0.43) | NPC1RECQLRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL5808816 | 0.80 | MEN1 (0.56) | MEN1GAAKMT2ACTSKCTSS | |
| SCHEMBL19578897 | 0.76 | CTSS (0.41) | NPC1RECQLRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL17373694 | 0.74 | AAK1 (0.47) | NPC1RECQLRAB9ASMN1; SMN2FPR3 | |
| SCHEMBL5877530 | 0.74 | AAK1 (0.50) | NPC1RECQLRAB9ASMN1; SMN2FPR3 | |
| SCHEMBL255676 | 0.74 | AAK1 (0.50) | NPC1RECQLRAB9ASMN1; SMN2FPR3 | |
| SCHEMBL30257063 | 0.74 | AAK1 (0.47) | NPC1RECQLRAB9ASMN1; SMN2FPR3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2635560-A1 | DIHYDROOXAZOL-2-AMINE DERIVATIVES | F.HOFFMANN-LA ROCHE AG (CH) | 2013-09-11 | — | — | EP | disclosed |
| EP-2499121-A1 | OXAZOLINE DERIVATIVES FOR TREATMENT OF CNS DISORDERS. | F. Hoffmann-La Roche AG (CH) | 2012-09-19 | — | — | EP | disclosed |
| WO-2012059371-A1 | DIHYDROOXAZOL-2-AMINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-05-10 | — | — | WO | disclosed |
| WO-2011057973-A1 | OXAZOLINE DERIVATIVES FOR TREATMENT OF CNS DISORDERS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-05-19 | — | — | WO | disclosed |