Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | KDM1A | O60341 | 5/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | RCOR1 | Q9UKL0 | 2/20 | 0.43 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3575917 | 0.97 | HDAC8 (0.50) | HDAC8HDAC6HDAC1KDM1AKCNH2 | |
| SCHEMBL21609716 | 0.95 | HDAC8 (0.48) | HDAC8HDAC6HDAC1KDM1AKCNH2 | |
| SCHEMBL126116 | 0.95 | HDAC8 (0.48) | HDAC8HDAC6HDAC1KDM1AKCNH2 | |
| SCHEMBL17061138 | 0.95 | HDAC8 (0.48) | HDAC8HDAC6HDAC1KDM1AKCNH2 | |
| SCHEMBL233178 | 0.92 | ESR2 (0.47) | HDAC8HDAC6HDAC1KDM1AKCNH2 | |
| SCHEMBL14804315 | 0.87 | KDM1A (0.48) | KDM1AKCNH2MAOBRCOR1KDM1B | |
| SCHEMBL265495 | 0.87 | KDM1A (0.48) | KDM1AKCNH2MAOBRCOR1KDM1B | |
| SCHEMBL781509 | 0.84 | HDAC1 (0.54) | HDAC8HDAC6HDAC1ESR2NOTUM | |
| SCHEMBL25274751 | 0.83 | HDAC8 (0.41) | HDAC8HDAC6HDAC1KDM1AKCNH2 | |
| Pyrrolidine SCHEMBL9026279 | 0.83 | CYP2D6 (0.45) | HDAC8HDAC6HDAC1KCNH2NPC1 |
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-4334319-A1 | 2,8-DIHYDROPYRAZOLO[3,4-B]INDOLE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER | Merck Patent GmbH (DE) | 2024-03-13 | — | — | EP | disclosed |
| EP-4146652-A1 | TRICYCLIC HETEROCYCLES USEFUL AS TEAD BINDERS | Merck Patent GmbH (DE) | 2023-03-15 | — | — | EP | disclosed |
| WO-2022233442-A1 | 2,8-DIHYDROPYRAZOLO[3,4-B]INDOLE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER | MERCK PATENT GMBH (DE) | 2022-11-10 | — | — | WO | disclosed |