Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 3/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | FLT3 | P36888 | 1/20 | 0.56 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.52 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.52 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | NCF1 | P14598 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL227023 | 1.00 | CYP2A6 (0.60) | CYP2A6CYP1A2FLT3HSD17B1HSD17B2 | |
| SCHEMBL7529485 | 0.98 | CYP2A6 (0.58) | CYP2A6CYP1A2FLT3HSD17B1HSD17B2 | |
| Ammonia Solution, Strong SCHEMBL8045635 | 0.98 | CYP2A6 (0.58) | CYP2A6CYP1A2FLT3HSD17B1HSD17B2 | |
| Methyl Alcohol SCHEMBL29235760 | 0.96 | FLT3 (0.57) | CYP2A6CYP1A2FLT3HSD17B1HSD17B2 | |
| SCHEMBL3138744 | 0.96 | CYP2A6 (0.61) | CYP2A6CYP1A2FLT3HSD17B1HSD17B2 | |
| SCHEMBL9381604 | 0.90 | CA12 (0.52) | CYP2A6CYP1A2FLT3HSD17B1HSD17B2 | |
| SCHEMBL1758778 | 0.85 | CYP2A6 (0.48) | CYP2A6CYP1A2FLT3HSD17B1HSD17B2 | |
| SCHEMBL29447161 | 0.84 | CYP1A2 (0.79) | CYP2A6CYP1A2HSD17B1HSD17B2KDM4E | |
| SCHEMBL443070 | 0.84 | CYP1A2 (0.79) | CYP2A6CYP1A2HSD17B1HSD17B2KDM4E | |
| SCHEMBL1129092 | 0.83 | HSD17B1 (0.66) | CYP2A6CYP1A2HSD17B1HSD17B2GSTP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025076285-A1 | COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME | DELPHIA THERAPEUTICS, INC. (US) | 2025-04-10 | — | — | WO | disclosed |
| EP-4065574-A1 | SUBSTITUTED AMINOQUINOLONES AS DGKALPHA INHIBITORS FOR IMMUNE ACTIVATION | Bayer Aktiengesellschaft (DE) | 2022-10-05 | — | — | EP | disclosed |