Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.52 |
| ▸ | ABHD6 | Q9BV23 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CPS1 | P31327 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | CFTR | P13569 | 1/20 | 0.35 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7421889 | 0.85 | ESR1 (0.51) | ESR1ESR2ABHD6HDAC6ALDH1A1 | |
| SCHEMBL7422936 | 0.80 | ESR1 (0.49) | ESR1ESR2ABHD6HDAC6HDAC8 | |
| SCHEMBL29405477 | 0.80 | ESR2 (0.56) | ESR1ESR2ABHD6 | |
| SCHEMBL22982260 | 0.80 | ESR2 (0.56) | ESR1ESR2ABHD6 | |
| SCHEMBL883735 | 0.79 | RAB9A (0.42) | ALDH1A1HPGDTSHRHSD17B10PKM | |
| SCHEMBL12438368 | 0.77 | ESR1 (0.54) | ESR1ESR2ABHD6HSD17B10MTNR1B | |
| SCHEMBL17823131 | 0.76 | ESR1 (0.51) | ESR1ESR2ABHD6HDAC6PKM | |
| SCHEMBL2310177 | 0.74 | ESR2 (0.52) | ESR1ESR2ABHD6HDAC6ALDH1A1 | |
| SCHEMBL7423484 | 0.74 | ESR1 (0.48) | ESR1ESR2ABHD6HDAC6ALDH1A1 | |
| SCHEMBL17798469 | 0.74 | ESR2 (0.55) | ESR1ESR2ABHD6HDAC6PKM |
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-0777667-A1 | CYCLIC BENZAZEPINE UREA DERIVATIVES WITH AGGREGATION-INHIBITING EFFECT | Dr. Karl Thomae GmbH (DE) | 1997-06-11 | — | — | EP | disclosed |
| WO-1996005194-A1 | CYCLIC BENZAZEPINE UREA DERIVATIVES WITH AGGREGATION-INHIBITING EFFECT | DR. KARL THOMAE GMBH (DE) | 1996-02-22 | — | — | WO | disclosed |