Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9700347 | 0.82 | RAB9A (0.39) | SMN1; SMN2KDM4EHPGDPTPN1ALDH1A1 | |
| SCHEMBL9701342 | 0.78 | GAA (0.46) | SMN1; SMN2KDM4EHPGDCYP2A6ALDH1A1 | |
| SCHEMBL9699266 | 0.76 | CYP2A6 (0.66) | SMN1; SMN2KDM4EHPGDCYP2A6PTPN1 | |
| SCHEMBL2774094 | 0.76 | SMN1; SMN2 (0.72) | SMN1; SMN2KDM4EHPGDPTPN1ALDH1A1 | |
| SCHEMBL9700316 | 0.74 | SMN1; SMN2 (0.47) | SMN1; SMN2KDM4EHPGDCYP2A6PTPN1 | |
| SCHEMBL9701379 | 0.73 | CYP1A2 (0.61) | SMN1; SMN2KDM4EHPGDCYP2A6ALDH1A1 | |
| SCHEMBL28482006 | 0.71 | CYP2A6 (0.58) | SMN1; SMN2KDM4EHPGDCYP2A6PTPN1 | |
| SCHEMBL17288589 | 0.69 | RARA (0.31) | KDM4ECES2CES1 | |
| SCHEMBL11247310 | 0.69 | ALDH1A1 (0.65) | SMN1; SMN2KDM4EHPGDALDH1A1NPC1 | |
| SCHEMBL2003577 | 0.69 | KMT2A (0.52) | SMN1; SMN2KDM4EHPGDPTPN1ALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5112820-A | Vision defects | STERLING DRUG INC. (US) | 1992-05-12 | — | — | US | disclosed |
| US-5109135-A | 2- or 3-aminomethyl-4-amino-3,4-dihydro-2H-1,4-benzoxazine intermediates | STERLING DRUG INC. (US) | 1992-04-28 | — | — | US | disclosed |
| US-5066803-A | Chemical intermediates for analgesics | STERLING DRUG INC. (US) | 1991-11-19 | — | — | US | disclosed |
| WO-1990007505-A1 | 2- AND 3-AMINOMETHYL-6-ARYLCARBONYL-2,3-DIHYDROPYRROLO[1,2,3-de]-1,4-BENZOXAZINES | STERLING DRUG INC. (US) | 1990-07-12 | — | — | WO | disclosed |
| US-4939138-A | 2- and 3-aminomethyl-6-arylcarbonyl-2,3-dihydropyrrolo(1,2,3-DE)-1,4-benzoxazines | STERLING DRUG INC. (US) | 1990-07-03 | — | — | US | disclosed |