Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | MIF | P14174 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | IDH1 | O75874 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL8704016 | 0.86 | TAAR1 (0.41) | SIGMAR1MIFALDH1A1HPGDLTA4H | |
| SCHEMBL8698949 | 0.81 | PKM (0.44) | MIFALDH1A1L3MBTL1PKMHPGD | |
| SCHEMBL5252911 | 0.73 | ALDH1A1 (0.47) | MIFALDH1A1L3MBTL1HPGDLMNA | |
| SCHEMBL18386658 | 0.72 | MIF (0.46) | MIFALDH1A1PKMHPGDMAPK1 | |
| SCHEMBL8703947 | 0.71 | MIF (0.41) | MIFALDH1A1PKMHPGDLTA4H | |
| SCHEMBL23079595 | 0.68 | HPGD (0.57) | ALDH1A1IDH1HPGDCALM1LMNA | |
| SCHEMBL19537846 | 0.68 | GPR3 (0.55) | ALDH1A1L3MBTL1IDH1HPGDCALM1 | |
| SCHEMBL16172323 | 0.68 | KCNH2 (0.36) | MIFALDH1A1PKMHPGDMAPK1 | |
| SCHEMBL17904048 | 0.65 | RXRA (0.51) | ALDH1A1L3MBTL1IDH1HPGDCALM1 | |
| SCHEMBL19155292 | 0.64 | AHR (0.52) | ALDH1A1IDH1HPGDCALM1KMT2A |
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-1998025913-A1 | NOVEL SUBSTITUTED 3H -BENZOXAZOLE-2-THIONES AND 3H -BENZOTHIAZOLE-2 THIONES DERIVATIVES, METHOD FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | ADIR ET COMPAGNIE (FR) | 1998-06-18 | — | — | WO | disclosed |