Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3R2 | O00459 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.32 |
| ▸ | WNT3A | P56704 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | ELANE | P08246 | 3/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27029300 | 0.79 | MAOA (0.40) | MAPTELANENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL31505247 | 0.75 | MAPT (0.31) | MAPTELANENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15656179 | 0.74 | TNKS (0.41) | TNKS2 | |
| SCHEMBL27029328 | 0.73 | TNKS2 (0.38) | TNKS2WNT3A | |
| SCHEMBL30097080 | 0.72 | ELANE (0.31) | PIK3R2PIK3CAPIK3CBELANE | |
| SCHEMBL30097106 | 0.70 | KDM4E (0.38) | TNKS2WNT3A | |
| SCHEMBL30097084 | 0.69 | ELANE (0.32) | ELANE | |
| SCHEMBL27029387 | 0.69 | ALDH1A1 (0.42) | MAPTELANENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL30097098 | 0.68 | MAPT (0.31) | MAPT | |
| SCHEMBL17844933 | 0.65 | CA12 (0.34) | — |
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-4308573-B1 | CYCLIC COMPOUNDS AND METHODS OF USING SAME | SCHROEDINGER INC (US) | 2025-05-07 | — | — | EP | disclosed |
| EP-4308573-A1 | CYCLIC COMPOUNDS AND METHODS OF USING SAME | Schrödinger, Inc. (US) | 2024-01-24 | — | — | EP | disclosed |
| WO-2022197898-A1 | CYCLIC COMPOUNDS AND METHODS OF USING SAME | SCHRÖDINGER, INC. (US) | 2022-09-22 | — | — | WO | disclosed |