Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | XDH | P47989 | 1/20 | 0.30 |
| ▸ | MET | P08581 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29703962 | 1.00 | KDM4C (0.47) | KDM4CL3MBTL1NPC1RAB9ACHEK1 | |
| SCHEMBL24517704 | 0.89 | KDM4C (0.47) | KDM4CL3MBTL1NPC1RAB9ACHEK1 | |
| SCHEMBL29703954 | 0.89 | KDM4C (0.47) | KDM4CL3MBTL1NPC1RAB9ACHEK1 | |
| SCHEMBL29703932 | 0.84 | KDM4C (0.43) | KDM4CL3MBTL1NPC1RAB9ACHEK1 | |
| SCHEMBL2527353 | 0.80 | KDM4C (0.43) | KDM4CL3MBTL1NPC1RAB9ACHEK1 | |
| SCHEMBL16668803 | 0.77 | KDM4C (0.43) | KDM4CL3MBTL1NPC1RAB9ACHEK1 | |
| SCHEMBL247949 | 0.76 | KDM4C (0.41) | KDM4CL3MBTL1NPC1RAB9ACHEK1 | |
| SCHEMBL24517557 | 0.75 | KDM4C (0.54) | KDM4CL3MBTL1NPC1RAB9ACHEK1 | |
| SCHEMBL7997302 | 0.75 | KDM4C (0.43) | KDM4CL3MBTL1NPC1RAB9ACHEK1 | |
| SCHEMBL2529327 | 0.73 | KDM4C (0.43) | KDM4CL3MBTL1NPC1RAB9ACHEK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022125412-A1 | TETRAHYDROQUINAZOLINE DERIVATIVES AS SELECTIVE CYTOTOXIC AGENTS | MERCK SHARP & DOHME CORP. (US) | 2022-06-16 | — | — | WO | disclosed |