Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 1/20 | 0.51 |
| ▸ | TACR3 | P29371 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | MC5R | P33032 | 3/20 | 0.43 |
| ▸ | MC3R | P41968 | 2/20 | 0.43 |
| ▸ | MC1R | Q01726 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MC4R | P32245 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6959388 | 0.94 | TACR1 (0.51) | TACR1TACR3ALDH1A1KMT2AMEN1 | |
| SCHEMBL6959582 | 0.92 | TACR1 (0.52) | TACR1TACR3ALDH1A1KMT2AMEN1 | |
| SCHEMBL6954843 | 0.86 | TACR3 (0.55) | TACR1TACR3ALDH1A1KMT2AMC5R | |
| SCHEMBL6954934 | 0.86 | TACR3 (0.55) | TACR1TACR3ALDH1A1KMT2AMC5R | |
| SCHEMBL6953209 | 0.85 | TACR1 (0.52) | TACR1TACR3ALDH1A1KMT2ABCHE | |
| SCHEMBL6952765 | 0.84 | TACR1 (0.52) | TACR1TACR3ALDH1A1KMT2AMC5R | |
| SCHEMBL6960163 | 0.83 | CARM1 (0.45) | KMT2AMEN1BCHE | |
| SCHEMBL6949095 | 0.83 | MEN1 (0.47) | TACR3ALDH1A1KMT2AMEN1KDM4E | |
| SCHEMBL6950820 | 0.81 | ALDH1A1 (0.47) | TACR3ALDH1A1KMT2AMEN1KDM4E | |
| SCHEMBL6958451 | 0.81 | TACR1 (0.55) | TACR1TACR3ALDH1A1KMT2AMEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0993458-B1 | 3-BENZYLPIPERIDINE | MERCK PATENT GMBH (DE) | 2003-04-09 | — | — | EP | disclosed |
| US-6333339-B1 | CENTRAL SYSTEM DISORDERS, SCHIZOPHRENIA AND COGNITION ACTIVATORS | MERCK PATENT GELLSCHAFT MIT BESCHRANKTER (DE) | 2001-12-25 | — | — | US | disclosed |
| EP-0993458-A1 | 3-BENZYLPIPERIDINE | MERCK PATENT GmbH (DE) | 2000-04-19 | — | — | EP | disclosed |
| WO-1998057953-A1 | 3-BENZYLPIPERIDINE | MERCK PATENT GMBH (DE) | 1998-12-23 | — | — | WO | disclosed |