Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10291393 | 0.86 | NPC1 (0.32) | NPC1RAB9A | |
| SCHEMBL10036193 | 0.84 | NPC1 (0.41) | NPC1RAB9A | |
| SCHEMBL20614364 | 0.74 | HTR2A (0.37) | — | |
| SCHEMBL19311575 | 0.74 | HTR2A (0.37) | — | |
| SCHEMBL10000241 | 0.71 | NPC1 (0.49) | NPC1RAB9A | |
| SCHEMBL15448627 | 0.71 | NPC1 (0.49) | NPC1RAB9A | |
| SCHEMBL10036194 | 0.71 | NPC1 (0.36) | NPC1RAB9A | |
| SCHEMBL4400230 | 0.70 | KDM1A (0.30) | — | |
| SCHEMBL14393110 | 0.67 | — | — | |
| SCHEMBL12290239 | 0.67 | — | — |
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-2265692-B1 | THIOPHENE DERIVATIVES, AND LC MEDIA CONTAINING THE SAME | MERCK PATENT GMBH (DE) | 2012-07-04 | — | — | EP | disclosed |
| WO-2009129915-A1 | THIOPHENE DERIVATIVES, AND LC MEDIA CONTAINING THE SAME | MERCK PATENT GMBH (DE) | 2009-10-29 | — | — | WO | disclosed |