Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 6/20 | 0.33 |
| ▸ | MAOA | P21397 | 6/20 | 0.33 |
| ▸ | MAOB | P27338 | 6/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31549868 | 0.97 | MMP2 (0.34) | KDM1AMAOAMAOB | |
| SCHEMBL27543362 | 0.89 | ELANE (0.34) | KDM1AMAOAMAOB | |
| SCHEMBL28704796 | 0.86 | — | — | |
| SCHEMBL27589277 | 0.86 | HSD11B1 (0.33) | — | |
| SCHEMBL10336368 | 0.85 | SLC6A2 (0.34) | MAOA | |
| SCHEMBL9796377 | 0.84 | SIGMAR1 (0.33) | KDM1AMAOAMAOB | |
| SCHEMBL3684573 | 0.84 | LMNA (0.34) | KDM1A | |
| SCHEMBL2783528 | 0.82 | — | — | |
| SCHEMBL20337296 | 0.82 | — | — | |
| SCHEMBL31424582 | 0.82 | SLC6A2 (0.38) | MAOAMAOB |
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 |
|---|---|---|---|---|---|---|---|
| US-5523473-A | OXIDIZING DIALKYL-SUBSTITUTED NAPHTHALENE OR DIARYL COMPOUND WITH GAS CONTAINING MOLECULAR OXYGEN UNDER LIQUID PHASE CONDITIONS IN PRESENCE OF CATALYST CONTAINING COPPER, BROMINE AND MANGANESE IN ORGANIC SOLVENT | NIPPON SHOKUBAI CO., LTD. (JP) | 1996-06-04 | — | — | US | disclosed |
| US-5144066-A | Oxidation of dialkyl-substituted naphthalene | NIPPON SHOKUBAI CO., LTD. (JP) | 1992-09-01 | — | — | US | disclosed |