Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | GFER | P55789 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | CASP1 | P29466 | 1/20 | 0.55 |
| ▸ | CASP7 | P55210 | 1/20 | 0.55 |
| ▸ | PARP1 | P09874 | 1/20 | 0.49 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | IKBKB | O14920 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17115290 | 0.98 | NISCH (0.64) | NISCHHSD17B10KDM4EGFERMAPT | |
| SCHEMBL6275705 | 0.95 | NISCH (0.64) | NISCHHSD17B10KDM4EGFERMAPT | |
| SCHEMBL4730000 | 0.79 | TAAR1 (0.60) | NISCHHSD17B10KDM4EGFERMAPT | |
| SCHEMBL22547812 | 0.77 | GFER (0.58) | NISCHHSD17B10KDM4EGFERMAPT | |
| SCHEMBL4727564 | 0.77 | TAAR1 (0.62) | NISCHHSD17B10KDM4EGFERMAPT | |
| SCHEMBL1991623 | 0.77 | NISCH (0.77) | NISCHHSD17B10KDM4EPARP1KMT2A | |
| SCHEMBL10748186 | 0.76 | NISCH (0.54) | NISCHHSD17B10KDM4EGFERMAPT | |
| Hydrochloric Acid SCHEMBL3314590 | 0.76 | NISCH (0.75) | NISCHHSD17B10KDM4EPARP1KMT2A | |
| SCHEMBL14115028 | 0.75 | GFER (0.55) | NISCHHSD17B10KDM4EGFERMAPT | |
| SCHEMBL6683286 | 0.74 | GFER (0.97) | HSD17B10KDM4EGFERMAPTALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| CN-119331020-A | Polycyclic nitrogen-containing heterocyclic compound and application thereof | 深圳艾克斯恩生物科技有限公司 | 2025-01-21 | — | — | CN | disclosed |
| WO-2016109706-A1 | FUSED POLYCYCLIC 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS | PTC THERAPEUTICS, INC. (US) | 2016-07-07 | — | — | WO | disclosed |