Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 9/20 | 0.51 |
| ▸ | RAB9A | P51151 | 6/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.50 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.50 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 5/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9840881 | 0.97 | NPC1 (0.49) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL9839309 | 0.96 | RARB (0.49) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL10719262 | 0.96 | RARB (0.49) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL9839453 | 0.96 | RARB (0.49) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL9840486 | 0.96 | RARB (0.49) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL9839399 | 0.96 | RARB (0.49) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL9840783 | 0.95 | NPC1 (0.49) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL9840467 | 0.95 | HDAC3 (0.50) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL9839327 | 0.93 | NPC1 (0.47) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL9840885 | 0.92 | RARB (0.47) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 |
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-0220297-B1 | NITROGEN-CONTAINING HETEROCYCLES | MERCK PATENT GmbH (DE) | 1991-12-11 | — | — | EP | disclosed |
| EP-0220297-A1 | NITROGEN-CONTAINING HETEROCYCLES. | MERCK PATENT GMBH (DE) | 1987-05-06 | — | — | EP | disclosed |
| WO-1986006373-A1 | NITROGEN-CONTAINING HETEROCYCLES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1986-11-06 | — | — | WO | disclosed |