Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.56 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.55 |
| ▸ | BRAF | P15056 | 6/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.55 |
| ▸ | HDAC7 | Q8WUI4 | 5/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.55 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.55 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.55 |
| ▸ | HDAC9 | Q9UKV0 | 5/20 | 0.55 |
| ▸ | HDAC5 | Q9UQL6 | 5/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | GCK | P35557 | 2/20 | 0.49 |
| ▸ | MMP13 | P45452 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL31557926 | 0.86 | BRAF (0.61) | HDAC8BRAFHDAC1HDAC3HDAC4 | |
| SCHEMBL20439216 | 0.84 | HPGD (0.61) | HPGDHTTSMN1; SMN2MMP13LMNA | |
| SCHEMBL13714246 | 0.83 | NR1H4 (0.65) | NR1H4MAPK1GFERTDP1SRD5A2 | |
| SCHEMBL15028056 | 0.83 | NR1H4 (0.53) | NR1H4HPGDSMN1; SMN2MAPK1GFER | |
| SCHEMBL23052920 | 0.82 | NR1H4 (0.56) | NR1H4HPGDSMN1; SMN2MAPK1GFER | |
| SCHEMBL31557904 | 0.81 | MEN1 (0.50) | HDAC8BRAFHDAC1HDAC3HDAC4 | |
| SCHEMBL8360010 | 0.80 | MTNR1A (0.56) | BRAFHDAC1HPGDHTTLMNA | |
| Hydrochloric Acid SCHEMBL27696847 | 0.79 | PARP10 (0.54) | NR1H4GCKSRD5A2CYP1A2CYP2C9 | |
| SCHEMBL28173271 | 0.78 | BRAF (0.49) | HDAC8BRAFHDAC1HDAC3HDAC4 | |
| SCHEMBL31557917 | 0.76 | BRAF (0.44) | NR1H4HDAC8BRAFHDAC1HDAC3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018140186-A1 | A PROCESS FOR PREPARING 5-PHENOXY-1(3H)ISOBENZOFURANONE | KINGCHEM LIFE SCIENCE LLC (US) | 2018-08-02 | — | — | WO | disclosed |