Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 6/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 6/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
| ▸ | APLNR | P35414 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.34 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23501651 | 1.00 | CYP2A6 (0.48) | CYP2A6HSD17B1CYP11B1CYP11B2CYP17A1 | |
| SCHEMBL6068143 | 0.77 | BACE1 (0.42) | CYP2A6HSD17B1CYP3A4CYP19A1HSD17B2 | |
| SCHEMBL8334091 | 0.76 | CYP2A6 (0.56) | CYP2A6HSD17B1CYP11B1CYP11B2HSD17B2 | |
| Hydrochloric Acid SCHEMBL6067839 | 0.75 | BACE1 (0.40) | CYP2A6HSD17B1CYP3A4CYP19A1HSD17B2 | |
| SCHEMBL12117526 | 0.74 | CYP2A6 (0.48) | CYP2A6CYP11B1CYP11B2CYP3A4DYRK1A | |
| SCHEMBL5799279 | 0.74 | PTK2 (0.52) | CYP2A6CYP11B1CYP11B2CYP19A1NPC1 | |
| SCHEMBL5027205 | 0.74 | CYP2A6 (0.48) | CYP2A6CYP11B1CYP11B2PIK3CGNPC1 | |
| SCHEMBL23501621 | 0.74 | CYP2A6 (0.48) | CYP2A6CYP11B1CYP11B2CYP3A4CYP19A1 | |
| SCHEMBL29933932 | 0.74 | CYP2A6 (0.48) | CYP2A6CYP11B1CYP11B2PIK3CGNPC1 | |
| SCHEMBL1319171 | 0.74 | MKNK1 (0.53) | CYP2A6KDM4EMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025021182-A1 | CYP11A1 INHIBITORS | ACERAND THERAPEUTICS (HONG KONG) LIMITED (CN) | 2025-01-30 | — | — | WO | disclosed |
| CN-119371371-A | Compounds and compositions as PDGF receptor kinase inhibitors | 日本新药株式会社 | 2025-01-28 | — | — | CN | disclosed |
| CN-115315421-B | Compounds and compositions as PDGF receptor kinase inhibitors | 日本新药株式会社 | 2024-12-03 | — | — | CN | disclosed |
| CN-115315421-A | Compounds and compositions as PDGF receptor kinase inhibitors | 日本新药株式会社 | 2022-11-08 | — | — | CN | disclosed |