Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | PKM | P14618 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | SYK | P43405 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 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 | |
|---|---|---|---|---|
| SCHEMBL26674594 | 1.00 | NPC1 (0.42) | NPC1SMN1; SMN2RAB9APKMTP53 | |
| SCHEMBL30641300 | 0.85 | NPC1 (0.43) | NPC1SMN1; SMN2RAB9APKMTP53 | |
| SCHEMBL26674581 | 0.85 | NPC1 (0.43) | NPC1SMN1; SMN2RAB9APKMTP53 | |
| SCHEMBL26674521 | 0.82 | EGFR (0.38) | NPC1SMN1; SMN2RAB9ALMNAJAK1 | |
| SCHEMBL2229315 | 0.71 | NPC1 (0.44) | NPC1SMN1; SMN2RAB9APKMTP53 | |
| SCHEMBL91451 | 0.70 | SMN1; SMN2 (0.67) | NPC1SMN1; SMN2RAB9ATP53LMNA | |
| SCHEMBL26674738 | 0.69 | ALDH1A1 (0.40) | NPC1SMN1; SMN2RAB9APOLBKMT2A | |
| SCHEMBL4624975 | 0.67 | NPC1 (0.65) | NPC1SMN1; SMN2RAB9APKMTP53 | |
| SCHEMBL2504479 | 0.67 | SYK (0.46) | NPC1SMN1; SMN2RAB9APKMTP53 | |
| SCHEMBL29524621 | 0.67 | KDM4E (0.41) | SMN1; SMN2TP53KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-119894872-A | Heteroarenes, pharmaceutical compositions containing heteroarenes, and methods of use thereof | 修复治疗公司 | 2025-04-25 | — | — | CN | disclosed |
| EP-4526293-A1 | HETEROARENES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND METHODS OF USING THE SAME | Repare Therapeutics Inc. (CA) | 2025-03-26 | — | — | EP | disclosed |
| WO-2023220831-A1 | HETEROARENES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND METHODS OF USING THE SAME | REPARE THERAPEUTICS INC. (CA) | 2023-11-23 | — | — | WO | disclosed |