Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABAT | P80404 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | DPP4 | P27487 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13497261 | 1.00 | ABAT (0.46) | ABATALDH1A1HTTLMNAKDM4E | |
| SCHEMBL15088720 | 1.00 | ABAT (0.46) | ABATALDH1A1HTTLMNAKDM4E | |
| SCHEMBL13497336 | 1.00 | ABAT (0.46) | ABATALDH1A1HTTLMNAKDM4E | |
| SCHEMBL13497255 | 1.00 | ABAT (0.46) | ABATALDH1A1HTTLMNAKDM4E | |
| SCHEMBL1828453 | 1.00 | ABAT (0.46) | ABATALDH1A1HTTLMNAKDM4E | |
| SCHEMBL13497265 | 1.00 | ABAT (0.46) | ABATALDH1A1HTTLMNAKDM4E | |
| SCHEMBL16501524 | 0.87 | TDP1 (0.33) | ABATHTTLMNAKDM4ETDP1 | |
| SCHEMBL16501533 | 0.87 | TDP1 (0.33) | ABATHTTLMNAKDM4ETDP1 | |
| SCHEMBL16501526 | 0.87 | TDP1 (0.33) | ABATHTTLMNAKDM4ETDP1 | |
| SCHEMBL16501522 | 0.87 | TDP1 (0.33) | ABATHTTLMNAKDM4ETDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2318383-B1 | PROCESS FOR PREPARING CYCLOALKYL-SUBSTITUTED PIPERAZINE COMPOUNDS | BOEHRINGER INGELHEIM INT (DE) | 2013-07-03 | — | — | EP | disclosed |
| WO-2010017850-A1 | PROCESS FOR PREPARING CYCLOALKYL-SUBSTITUTED PIPERAZINE COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-02-18 | — | — | WO | disclosed |