Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | FAAH | O00519 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5012835 | 0.89 | ALDH1A1 (0.52) | ALDH1A1HPGDTSHRMAPK10NPC1 | |
| SCHEMBL5015742 | 0.89 | ALDH1A1 (0.52) | ALDH1A1HPGDTSHRMAPK10NPC1 | |
| SCHEMBL5130690 | 0.88 | LMNA (0.57) | ALDH1A1HPGDTSHRMAPK10NPC1 | |
| SCHEMBL5012834 | 0.88 | ALDH1A1 (0.45) | ALDH1A1RAB9AFAAH | |
| SCHEMBL5124994 | 0.84 | ALDH1A1 (0.51) | ALDH1A1HPGDTSHRMAPK10NPC1 | |
| SCHEMBL5123554 | 0.84 | ALDH1A1 (0.51) | ALDH1A1HPGDTSHRMAPK10NPC1 | |
| SCHEMBL5014474 | 0.84 | TDP1 (0.47) | ALDH1A1MAPK10NPC1RAB9AKMT2A | |
| SCHEMBL5015753 | 0.84 | RAB9A (0.41) | HPGDTSHRNPC1RAB9AKMT2A | |
| SCHEMBL5014439 | 0.83 | TDP1 (0.47) | ALDH1A1HPGDTSHRMAPK10NPC1 | |
| SCHEMBL16175499 | 0.83 | TDP1 (0.46) | ALDH1A1TSHRMAPK10NPC1RAB9A |
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-1888596-B1 | SUBSTITUTED SPIRO COMPOUNDS AND THEIR USE FOR PRODUCING PAIN-RELIEF MEDICAMENTS | GRUENENTHAL GMBH (DE) | 2014-10-22 | — | — | EP | claimed |
| EP-1888596-A1 | SUBSTITUTED SPIRO COMPOUNDS AND THEIR USE FOR PRODUCING PAIN-RELIEF MEDICAMENTS | Grünenthal GmbH (DE) | 2008-02-20 | — | — | EP | claimed |
| WO-2006122770-A1 | SUBSTITUTED SPIRO COMPOUNDS AND THEIR USE FOR PRODUCING PAIN-RELIEF MEDICAMENTS | Grünenthal GmbH (DE) | 2006-11-23 | — | — | WO | claimed |
| EP-1888596-B1 | SUBSTITUTED SPIRO COMPOUNDS AND THEIR USE FOR PRODUCING PAIN-RELIEF MEDICAMENTS | GRUENENTHAL GMBH (DE) | 2014-10-22 | — | — | EP | disclosed |