Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL179133 | 0.88 | PTPN2 (0.49) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL179131 | 0.88 | ULK1 (0.50) | ALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL119244 | 0.84 | P2RX7 (0.39) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL118397 | 0.84 | ENPP2 (0.39) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL117356 | 0.84 | ENPP2 (0.50) | — | |
| SCHEMBL118794 | 0.83 | ENPP2 (0.46) | — | |
| SCHEMBL118895 | 0.82 | HPGD (0.44) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL116941 | 0.82 | MCHR1 (0.42) | KMT2A | |
| SCHEMBL16252470 | 0.82 | ENPP2 (0.41) | KMT2A | |
| SCHEMBL118460 | 0.81 | ENPP2 (0.42) | KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010115491-A2 | PIPERIDINE AND PIPERAZINE DERIVATIVES AS AUTOTAXIN INHIBITORS | MERCK PATENT GMBH (DE) | 2010-10-14 | — | — | WO | claimed |
| EP-2414330-A2 | PIPERIDINE AND PIPERAZINE DERIVATIVES AS AUTOTAXIN INHIBITORS | Merck Patent GmbH (DE) | 2012-02-08 | — | — | EP | disclosed |
| WO-2010115491-A2 | PIPERIDINE AND PIPERAZINE DERIVATIVES AS AUTOTAXIN INHIBITORS | MERCK PATENT GMBH (DE) | 2010-10-14 | — | — | WO | disclosed |