Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.79 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.79 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.79 |
| ▸ | USP2 | O75604 | 1/20 | 0.79 |
| ▸ | ESR1 | P03372 | 1/20 | 0.79 |
| ▸ | POLB | P06746 | 1/20 | 0.79 |
| ▸ | THRB | P10828 | 1/20 | 0.79 |
| ▸ | HPGD | P15428 | 1/20 | 0.79 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.79 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.79 |
| ▸ | RECQL | P46063 | 1/20 | 0.79 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.79 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.79 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | HTT | P42858 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL11021033 | 1.00 | HSD17B10 (0.79) | HSD17B10KDM4ETDP1USP2ESR1 | |
| SCHEMBL10897219 | 1.00 | HSD17B10 (0.79) | HSD17B10KDM4ETDP1USP2ESR1 | |
| SCHEMBL8477667 | 0.88 | HSD17B10 (1.00) | HSD17B10KDM4ETDP1USP2ESR1 | |
| SCHEMBL8477662 | 0.88 | HSD17B10 (1.00) | HSD17B10KDM4ETDP1USP2ESR1 | |
| SCHEMBL2117385 | 0.88 | HSD17B10 (1.00) | HSD17B10KDM4ETDP1USP2ESR1 | |
| SCHEMBL11021134 | 0.86 | POLB (0.58) | HSD17B10KDM4ETDP1USP2ESR1 | |
| SCHEMBL11021133 | 0.86 | POLB (0.58) | HSD17B10KDM4ETDP1USP2ESR1 | |
| SCHEMBL10898402 | 0.86 | POLB (0.58) | HSD17B10KDM4ETDP1USP2ESR1 | |
| SCHEMBL9189547 | 0.86 | KDM4E (0.58) | HSD17B10KDM4ETDP1USP2ESR1 | |
| SCHEMBL30923534 | 0.86 | HSD17B10 (0.79) | HSD17B10KDM4ETDP1USP2ESR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118291562-A | Preparation method of (2S, 3S) -2, 3-dihydro-3-hydroxy-2-aryl-1, 5-benzothiazepine-4 (5H) -ketone compound | 复旦大学 | 2024-07-05 | — | — | CN | disclosed |
| EP-0158340-A2 | Novel 1,5-benzothiazepine derivative, processes for preparing the same and pharmaceutical compositions | Tanabe Seiyaku Co., Ltd. (JP) | 1985-10-16 | — | — | EP | disclosed |