Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | THRB | P10828 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | THPO | P40225 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | CYP19A1 | P11511 | 7/20 | 0.47 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.40 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | SRD5A1 | P18405 | 5/20 | 0.38 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30912593 | 1.00 | KDM4E (0.54) | KDM4ETHRBTSHRCYP3A4THPO | |
| SCHEMBL30912576 | 1.00 | KDM4E (0.54) | KDM4ETHRBTSHRCYP3A4THPO | |
| SCHEMBL13521128 | 0.82 | CYP3A4 (0.54) | KDM4ETHRBTSHRCYP3A4THPO | |
| SCHEMBL22781363 | 0.82 | SRD5A1 (0.57) | KDM4ETHRBTSHRCYP3A4THPO | |
| SCHEMBL3140704 | 0.82 | CYP3A4 (0.54) | KDM4ETHRBTSHRCYP3A4THPO | |
| SCHEMBL13225803 | 0.81 | KDM4E (0.66) | KDM4ETHRBTSHRCYP3A4THPO | |
| SCHEMBL11708369 | 0.81 | KDM4E (0.66) | KDM4ETHRBTSHRCYP3A4THPO | |
| SCHEMBL5309109 | 0.76 | CYP19A1 (0.41) | KDM4ETHRBTSHRCYP3A4THPO | |
| SCHEMBL30912493 | 0.76 | KDM4E (0.48) | KDM4ETHRBTSHRCYP3A4THPO | |
| SCHEMBL9414375 | 0.75 | TSHR (0.50) | KDM4ETHRBTSHRCYP3A4THPO |
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-4619406-A1 | TRICYCLIC COMPOUNDS | Schrödinger, Inc. (US) | 2025-09-24 | — | — | EP | disclosed |
| WO-2024107393-A1 | TRICYCLIC COMPOUNDS | SCHRÖDINGER, INC. (US) | 2024-05-23 | — | — | WO | disclosed |