Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5118051 | 0.85 | MEN1 (0.52) | CHRNB4CHRNA3KMT2AMEN1NPSR1 | |
| Ammonia Solution, Strong SCHEMBL5123937 | 0.84 | MEN1 (0.51) | CHRNB4CHRNA3KMT2AMEN1NPSR1 | |
| SCHEMBL2479652 | 0.79 | ALDH1A1 (0.44) | KMT2AMEN1NPSR1NPC1RAB9A | |
| SCHEMBL5012838 | 0.78 | KMT2A (0.47) | CHRNB4CHRNA3KMT2A | |
| SCHEMBL16175709 | 0.78 | CHRNB4 (0.41) | CHRNB4CHRNA3KMT2A | |
| SCHEMBL16175603 | 0.77 | KMT2A (0.41) | KMT2ANPC1RAB9A | |
| SCHEMBL5012687 | 0.76 | RAB9A (0.47) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5012860 | 0.75 | HTT (0.41) | CHRNB4CHRNA3KMT2A | |
| SCHEMBL5012695 | 0.74 | SIGMAR1 (0.48) | CHRNB4CHRNA3 | |
| SCHEMBL5015672 | 0.74 | FAAH (0.43) | CHRNB4CHRNA3KMT2ANPSR1 |
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 3 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 | disclosed |
| EP-1888596-A1 | SUBSTITUTED SPIRO COMPOUNDS AND THEIR USE FOR PRODUCING PAIN-RELIEF MEDICAMENTS | Grünenthal GmbH (DE) | 2008-02-20 | — | — | EP | disclosed |
| WO-2006122770-A1 | SUBSTITUTED SPIRO COMPOUNDS AND THEIR USE FOR PRODUCING PAIN-RELIEF MEDICAMENTS | Grünenthal GmbH (DE) | 2006-11-23 | — | — | WO | disclosed |