Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | BTK | Q06187 | 1/20 | 0.37 |
| ▸ | KCNA1 | Q09470 | 2/20 | 0.37 |
| ▸ | KCNAB1 | Q14722 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.36 |
| ▸ | MERTK | Q12866 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8559726 | 0.76 | ESR1 (0.46) | ESR1ESR2HDAC6MEN1KMT2A | |
| SCHEMBL719483 | 0.75 | ESR1 (0.52) | ESR1ESR2HDAC6RAB9AKCNA1 | |
| SCHEMBL7422272 | 0.74 | ESR1 (0.51) | ESR1ESR2HDAC6BTKKCNA1 | |
| SCHEMBL13334504 | 0.73 | ESR1 (0.56) | ESR1ESR2MEN1KMT2AMAPT | |
| SCHEMBL7471562 | 0.73 | ESR1 (0.50) | ESR1ESR2HDAC6BTKKCNA1 | |
| SCHEMBL2309023 | 0.70 | ESR1 (0.85) | ESR1ESR2HDAC6KCNA1KCNAB1 | |
| SCHEMBL12110148 | 0.69 | CYP2C19 (0.61) | MEN1KMT2AMAPTLMNAKDM4E | |
| SCHEMBL14677183 | 0.69 | ESR2 (0.59) | ESR1ESR2HDAC6MEN1KMT2A | |
| SCHEMBL21834082 | 0.69 | ESR1 (0.57) | ESR1ESR2HDAC6MEN1KMT2A | |
| SCHEMBL31670363 | 0.69 | ESR1 (0.57) | ESR1ESR2HDAC6MEN1KMT2A |
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 |