Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 6/20 | 0.43 |
| ▸ | CA1 | P00915 | 5/20 | 0.43 |
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.40 |
| ▸ | IDH1 | O75874 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8864610 | 0.83 | HPGD (0.61) | MAPK1SMN1; SMN2CA2CA1HPGD | |
| SCHEMBL1345154 | 0.81 | MAPK1 (0.58) | MAPK1SMN1; SMN2PTPN1PTPN11CA2 | |
| SCHEMBL1344975 | 0.81 | MAPK1 (0.58) | MAPK1SMN1; SMN2PTPN1PTPN11CA2 | |
| SCHEMBL2528782 | 0.81 | TRPV1 (0.49) | CA2CA1 | |
| SCHEMBL966433 | 0.80 | MAPK1 (0.56) | MAPK1SMN1; SMN2PTPN1PTPN11CA2 | |
| SCHEMBL691500 | 0.79 | HPGD (0.68) | MAPK1SMN1; SMN2PTPN1CA2CA1 | |
| SCHEMBL1821726 | 0.78 | CXCR2 (0.61) | SMN1; SMN2LMNACXCR2PTGS2 | |
| SCHEMBL12905148 | 0.77 | PTPN11 (0.54) | MAPK1SMN1; SMN2PTPN1PTPN11CA2 | |
| SCHEMBL11589542 | 0.77 | POLB (0.63) | MAPK1SMN1; SMN2PTPN1PTPN11CA2 | |
| SCHEMBL11586901 | 0.76 | LMNA (0.47) | SMN1; SMN2CA2CA1CA12CA9 |
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 |
|---|---|---|---|---|---|---|---|
| US-5624922-A | Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents | STERLING WINTHROP INC. (US) | 1997-04-29 | — | — | US | disclosed |
| EP-0597540-B1 | Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents | STERLING WINTHROP INC (US) | 1996-06-05 | — | — | EP | disclosed |
| US-5380721-A | Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents | STERLING WINTHROP INC. (US) | 1995-01-10 | — | — | US | disclosed |
| EP-0597540-A1 | Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents | STERLING WINTHROP INC. (US) | 1994-05-18 | — | — | EP | disclosed |