Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESRRG | P62508 | 13/20 | 0.70 |
| ▸ | ESR1 | P03372 | 4/20 | 0.70 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.70 |
| ▸ | FADS1 | O60427 | 1/20 | 0.58 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.54 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.54 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | PPARG | P37231 | 1/20 | 0.53 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.53 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.53 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.52 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.50 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL31337407 | 0.86 | ESRRG (0.64) | ESRRGESR1ESR2P2RX1NPC1 | |
| SCHEMBL31337226 | 0.85 | NPC1 (0.68) | ESRRGNPC1RAB9APPARGNCOA2 | |
| SCHEMBL31337285 | 0.82 | ESRRG (1.00) | ESRRGESR1ESR2NPC1RAB9A | |
| SCHEMBL31337222 | 0.80 | ESRRG (1.00) | ESRRGESR1ESR2NPC1RAB9A | |
| SCHEMBL31337223 | 0.76 | KCNH2 (0.80) | ESRRGESR1ESR2NPC1RAB9A | |
| SCHEMBL31337210 | 0.76 | ESR1 (0.64) | ESRRGESR1ESR2FADS1P2RX1 | |
| SCHEMBL17732037 | 0.75 | KMT2A (0.67) | FADS1P2RX1P2RX4P2RX7NPC1 | |
| SCHEMBL31337402 | 0.74 | KCNH2 (0.62) | ESRRGESR1ESR2NPC1RAB9A | |
| SCHEMBL2701738 | 0.74 | FADS1 (1.00) | FADS1P2RX1P2RX4P2RX7NPC1 | |
| SCHEMBL20764032 | 0.72 | ESRRG (0.79) | ESRRGESR1NPC1RAB9APPARG |
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-2025022031-A1 | NEW DERIVATIVES USEFUL AS ANTIBACTERIAL AGENTS | CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (CSIC) (ES) | 2025-01-30 | — | — | WO | disclosed |