Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA6 | P23280 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 3/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | P4HB | P07237 | 1/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.39 |
| ▸ | SLC2A4 | P14672 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10499889 | 0.84 | LMNA (0.45) | RAB9ACA12CA1CA2CA9 | |
| SCHEMBL8475792 | 0.83 | ESR1 (0.39) | NPC1RAB9AESR1ESR2PARP1 | |
| SCHEMBL10499188 | 0.78 | ESR1 (0.40) | NPC1RAB9AESR1ESR2ALDH1A1 | |
| SCHEMBL7599259 | 0.74 | ALDH1A1 (0.36) | ALDH1A1MAPTKMT2AL3MBTL1TSHR | |
| SCHEMBL7092637 | 0.74 | CYP3A4 (0.42) | CA12CA2CA9ESR1ESR2 | |
| SCHEMBL476117 | 0.73 | CES2 (0.38) | ESR1KDM4EALDH1A1GAAMAPT | |
| SCHEMBL7816710 | 0.72 | TSHR (0.47) | NPC1RAB9AESR1ESR2ALDH1A1 | |
| SCHEMBL21461987 | 0.72 | ADRB2 (0.46) | NPC1RAB9ACA12CA1CA2 | |
| SCHEMBL68806 | 0.72 | ESR1 (0.53) | NPC1RAB9ACA12CA1CA2 | |
| SCHEMBL8795081 | 0.72 | ELANE (0.41) | NPC1ALDH1A1MEN1KMT2AL3MBTL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4849419-A | 7-oxo-4-thia-azabicyclo[3,2,0]hept-2-ene derivatives | HOECHST UK LIMITED (GB) | 1989-07-18 | — | — | US | disclosed |
| US-4795748-A | Antibacterial 7-oxo-4-thia-1-azabicyclo[3,2,0]hept-2-ene derivatives | HOECHST UK LIMITED (GB) | 1989-01-03 | — | — | US | disclosed |
| EP-0174561-A1 | 7-Oxo-4-thia-1-azabicyclo[3,2,0]hept-2-ene derivatives | HOECHST UK LIMITED (GB) | 1986-03-19 | — | — | EP | disclosed |
| EP-0170028-A1 | Antibacterial 7-oxo-4-thia-1-azabicyclo[3,2,0]hept-2-ene derivatives | HOECHST UK LIMITED (GB) | 1986-02-05 | — | — | EP | disclosed |