Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9879144 | 0.86 | PKM (0.50) | SMN1; SMN2PKMTSHRCYP3A4NPSR1 | |
| SCHEMBL1035975 | 0.83 | SMN1; SMN2 (0.49) | SMN1; SMN2PKMTSHRCYP3A4NPSR1 | |
| SCHEMBL9879414 | 0.81 | PKM (0.46) | SMN1; SMN2PKMTSHRCYP3A4NPSR1 | |
| SCHEMBL27466587 | 0.80 | CYP3A4 (0.54) | SMN1; SMN2CYP3A4RIPK1CYP2C19ALDH1A1 | |
| SCHEMBL8650273 | 0.77 | TSHR (0.58) | SMN1; SMN2PKMTSHRCYP3A4NPSR1 | |
| SCHEMBL11091345 | 0.77 | SMN1; SMN2 (0.56) | SMN1; SMN2PKMTSHRCYP3A4NPSR1 | |
| Fenipentol SCHEMBL27854652 | 0.77 | NPC1 (0.47) | SMN1; SMN2TSHRCYP3A4RIPK1ALDH1A1 | |
| SCHEMBL9292329 | 0.76 | CYP3A4 (0.51) | SMN1; SMN2PKMTSHRCYP3A4NPSR1 | |
| SCHEMBL11061194 | 0.76 | PKM (0.55) | SMN1; SMN2PKMTSHRCYP3A4NPSR1 | |
| Biphenyl SCHEMBL10749847 | 0.76 | PKM (0.55) | SMN1; SMN2PKMTSHRCYP3A4NPSR1 |
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-5008285-A | Antiarthritic agent with low gastric irritability side effect | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1991-04-16 | — | — | US | disclosed |
| EP-0159684-B1 | (6,11-DIHYDRO-11-OXODIBENZ(B,E)OXEPINYL)PENTANOIC ACIDS AND DERIVATIVES, A PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1989-09-27 | — | — | EP | disclosed |