Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | MAOA | P21397 | 1/20 | 0.58 |
| ▸ | CA12 | O43570 | 3/20 | 0.55 |
| ▸ | CA1 | P00915 | 3/20 | 0.55 |
| ▸ | CA2 | P00918 | 3/20 | 0.55 |
| ▸ | CA7 | P43166 | 3/20 | 0.55 |
| ▸ | CA9 | Q16790 | 3/20 | 0.55 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.55 |
| ▸ | ESR1 | P03372 | 2/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2725407 | 1.00 | NPC1 (0.60) | NPC1CYP1A2LMNACYP3A4MAOA | |
| SCHEMBL1278720 | 0.89 | NPC1 (0.68) | NPC1CYP1A2LMNACYP3A4MAOA | |
| SCHEMBL2810136 | 0.89 | NPC1 (0.68) | NPC1CYP1A2LMNACYP3A4MAOA | |
| Hydrochloric Acid SCHEMBL9156219 | 0.87 | NPC1 (0.66) | NPC1CYP1A2LMNACYP3A4MAOA | |
| SCHEMBL10180584 | 0.87 | CA12 (0.64) | NPC1CYP1A2LMNACYP3A4MAOA | |
| SCHEMBL2712707 | 0.87 | CA12 (0.64) | NPC1CYP1A2LMNACYP3A4MAOA | |
| SCHEMBL584117 | 0.84 | NPC1 (0.62) | NPC1CYP1A2LMNACYP3A4MAOA | |
| SCHEMBL19386187 | 0.82 | CA12 (0.55) | NPC1CYP1A2LMNACYP3A4MAOA | |
| SCHEMBL330220 | 0.82 | NPC1 (0.60) | NPC1CYP1A2LMNACYP3A4MAOA | |
| SCHEMBL29649183 | 0.82 | NPC1 (0.60) | NPC1CYP1A2LMNACYP3A4MAOA |
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-4308554-A1 | COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING TYPE 2 DIABETES AND DEMENTIA | The Board of Trustees of the University of Illinois (US) | 2024-01-24 | — | — | EP | disclosed |
| WO-2022197658-A1 | COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING TYPE 2 DIABETES AND DEMENTIA | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2022-09-22 | — | — | WO | disclosed |