Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 6/20 | 0.41 |
| ▸ | MITF | O75030 | 2/20 | 0.41 |
| ▸ | CCR6 | P51684 | 1/20 | 0.41 |
| ▸ | KDM4A | O75164 | 1/20 | 0.40 |
| ▸ | KDM4B | O94953 | 1/20 | 0.40 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29720656 | 1.00 | ADORA3 (0.42) | ADORA3SMN1; SMN2L3MBTL1MITFCCR6 | |
| SCHEMBL24128110 | 1.00 | ADORA3 (0.42) | ADORA3SMN1; SMN2L3MBTL1MITFCCR6 | |
| SCHEMBL26038568 | 0.83 | BRD4 (0.43) | ADORA3SMN1; SMN2KDM4AKDM4BKDM5B | |
| SCHEMBL30481834 | 0.83 | ADORA3 (0.47) | ADORA3SMN1; SMN2KDM4AKDM4BKDM5B | |
| SCHEMBL24128111 | 0.83 | ADORA3 (0.47) | ADORA3SMN1; SMN2KDM4AKDM4BKDM5B | |
| SCHEMBL24128116 | 0.83 | NPC1 (0.44) | ADORA3SMN1; SMN2L3MBTL1MITFKDM4A | |
| SCHEMBL24128109 | 0.83 | TGFBR1 (0.43) | ADORA3SMN1; SMN2L3MBTL1ADORA2AALDH1A1 | |
| SCHEMBL30481876 | 0.83 | TGFBR1 (0.43) | ADORA3SMN1; SMN2L3MBTL1ADORA2AALDH1A1 | |
| SCHEMBL29720521 | 0.82 | CSNK2A1 (0.43) | ADORA3SMN1; SMN2L3MBTL1KDM4AKDM4B | |
| SCHEMBL26042492 | 0.82 | CSNK2A1 (0.43) | ADORA3SMN1; SMN2L3MBTL1KDM4AKDM4B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4168414-A1 | SUBSTITUTED THIENOPYRIMIDINES THAT INTERACT WITH THE RAS SUPERFAMILY FOR THE TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE | Shy Therapeutics LLC (US) | 2023-04-26 | — | — | EP | disclosed |
| WO-2021257828-A9 | SUBSTITUTED THIENOPYRIMIDINES THAT INTERACT WITH THE RAS SUPERFAMILY FOR THE TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE | SHY THERAPEUTICS, LLC (US) | 2022-07-21 | — | — | WO | disclosed |