Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.67 |
| ▸ | ATM | Q13315 | 2/20 | 0.67 |
| ▸ | GLA | P06280 | 1/20 | 0.67 |
| ▸ | GAA | P10253 | 1/20 | 0.67 |
| ▸ | MAPT | P10636 | 1/20 | 0.67 |
| ▸ | HTT | P42858 | 1/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.67 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.57 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | DRD4 | P21917 | 3/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.53 |
| ▸ | DRD3 | P35462 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL2855576 | 0.84 | SIGMAR1 (0.68) | SIGMAR1KDM4EALDH1A1ATMGLA | |
| SCHEMBL12013921 | 0.84 | ACHE (0.70) | SIGMAR1KDM4EALDH1A1ATMGLA | |
| SCHEMBL14981031 | 0.83 | L3MBTL1 (0.58) | SIGMAR1KDM4EALDH1A1ATMGLA | |
| SCHEMBL266138 | 0.83 | NPC1 (0.71) | SIGMAR1ALDH1A1CXCR4NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL11538526 | 0.83 | SIGMAR1 (0.66) | SIGMAR1KDM4EALDH1A1ATMGLA | |
| SCHEMBL10989753 | 0.82 | DRD2 (0.60) | SIGMAR1KDM4EALDH1A1GAANPC1 | |
| SCHEMBL2073184 | 0.82 | SIGMAR1 (0.65) | SIGMAR1KDM4EALDH1A1ATMGLA | |
| SCHEMBL29767413 | 0.81 | MAPT (0.72) | SIGMAR1KDM4EALDH1A1ATMGLA | |
| SCHEMBL3169406 | 0.81 | SIGMAR1 (0.79) | SIGMAR1KDM4EALDH1A1ATMGLA | |
| Hydrochloric Acid SCHEMBL28652893 | 0.81 | NPC1 (0.69) | SIGMAR1ALDH1A1CXCR4NPC1RAB9A |
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 6 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 |
| US-4639522-A | HYPOTENSIVES | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1987-01-27 | — | — | US | disclosed |