Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 6/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23618319 | 0.88 | ABCB1 (0.42) | PDE10ANPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL26260644 | 0.88 | NPC1 (0.40) | PDE10ANPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL26261593 | 0.88 | NPC1 (0.38) | PDE10ANPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL23618304 | 0.88 | NPC1 (0.40) | PDE10ANPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL25436191 | 0.86 | SMN1; SMN2 (0.42) | PDE10ANPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL23618336 | 0.86 | NPC1 (0.44) | PDE10ANPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL26260667 | 0.86 | ENPP1 (0.39) | PDE10ANPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL26260655 | 0.85 | PARP14 (0.43) | PDE10ANPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL30041437 | 0.85 | ABCB1 (0.35) | PDE10ANPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL25400510 | 0.85 | ABCB1 (0.35) | PDE10ANPC1RAB9ASMN1; SMN2CYP1A2 |
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-4085054-B1 | NEW PQSR INVERSE AGONISTS | HELMHOLTZ ZENTRUM INFEKTIONSFORSCHUNG GMBH (DE) | 2025-02-19 | — | — | EP | disclosed |
| EP-4085054-A1 | NEW PQSR INVERSE AGONISTS | Helmholtz-Zentrum für Infektionsforschung GmbH (DE) | 2022-11-09 | — | — | EP | disclosed |