Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.66 |
| ▸ | MEN1 | O00255 | 2/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.62 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL25212788 | 0.91 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2MEN1KMT2ASIGMAR1 | |
| SCHEMBL29864671 | 0.91 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2MEN1KMT2ASIGMAR1 | |
| SCHEMBL16226986 | 0.84 | ALDH1A1 (0.82) | ALDH1A1SMN1; SMN2MEN1KMT2ASIGMAR1 | |
| SCHEMBL30089449 | 0.84 | ALDH1A1 (0.66) | ALDH1A1SMN1; SMN2MEN1KMT2ASIGMAR1 | |
| SCHEMBL6944257 | 0.84 | ALDH1A1 (0.66) | ALDH1A1SMN1; SMN2MEN1KMT2ASIGMAR1 | |
| SCHEMBL12013927 | 0.84 | ALDH1A1 (0.66) | ALDH1A1SMN1; SMN2MEN1KMT2ASIGMAR1 | |
| SCHEMBL10989753 | 0.82 | DRD2 (0.60) | ALDH1A1SIGMAR1HSD17B10ALOX15KDM4E | |
| SCHEMBL1519149 | 0.82 | SIGMAR1 (0.65) | ALDH1A1SMN1; SMN2MEN1KMT2ASIGMAR1 | |
| SCHEMBL5360595 | 0.81 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2MEN1KMT2ASIGMAR1 | |
| SCHEMBL12513635 | 0.81 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2MEN1KMT2ASIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1084329-C | Benzyl piepridine derivs as pharmaceutical agents | HOFFMANN LA ROCHE (CH) | 2002-05-08 | — | — | CN | disclosed |
| EP-0871613-A1 | BENZYL PIPERIDINE DERIVATIVES AS PHARMACEUTICAL AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 1998-10-21 | — | — | EP | disclosed |
| CN-1183768-A | Benzyl piepridine derivs as pharmaceutical agents | HOFFMANN LA ROCHE (CH) | 1998-06-03 | — | — | CN | disclosed |
| US-5753679-A | SCIZOPHRENIA | HOFFMANN-LA ROCHE INC. (US) | 1998-05-19 | — | — | US | disclosed |
| WO-1996035666-A1 | BENZYL PIPERIDINE DERIVATIVES AS PHARMACEUTICAL AGENTS | F.HOFFMANN-LA ROCHE AG (CH) | 1996-11-14 | — | — | WO | disclosed |