Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | APEX1 | P27695 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | BCL2 | P10415 | 2/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8781998 | 0.84 | MAOB (0.50) | TP53POLBMAPK1MAOBRAB9A | |
| SCHEMBL9442083 | 0.83 | HIF1A (0.48) | MAPK1MAOBRAB9ANPC1KMT2A | |
| SCHEMBL8618464 | 0.82 | HIF1A (0.57) | ESR1TP53POLBAPEX1MAPK1 | |
| SCHEMBL8618468 | 0.82 | HIF1A (0.57) | ESR1TP53POLBAPEX1MAPK1 | |
| SCHEMBL8076831 | 0.80 | PTPRC (0.51) | TP53MAOBRAB9ANPC1KDM4E | |
| SCHEMBL8782222 | 0.79 | NR4A2 (0.51) | TP53MAOBRAB9ANPC1KMT2A | |
| SCHEMBL7537186 | 0.79 | PTGDR2 (0.50) | TP53TDP1RAB9ANPC1MAPT | |
| SCHEMBL13794698 | 0.79 | TDP1 (0.51) | ESR1TP53POLBAPEX1MAPK1 | |
| SCHEMBL8782089 | 0.78 | RXRA (0.50) | L3MBTL1MAOBRAB9ANPC1HSP90AA1 | |
| SCHEMBL8781928 | 0.78 | RXRA (0.52) | TP53MAOBRAB9ANPC1KDM4E |
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-0718279-B1 | Process for the preparation of o-substituted benzoylcyanides | BASF AG (DE) | 1997-09-24 | — | — | EP | claimed |
| US-5221762-A | Reacting a phenol with benzolactone compound; then phosgene or thionyl chloride; esterification with alcohol | BASF AKTIENGESELLSCHAFT (DE) | 1993-06-22 | — | — | US | disclosed |