Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMO | O15229 | 3/20 | 0.35 |
| ▸ | KAT7 | O95251 | 1/20 | 0.35 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | MIF | P14174 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8703947 | 0.82 | MIF (0.41) | ALDH1A1KDM4EMIFPKMHTT | |
| SCHEMBL8704872 | 0.76 | ALDH1A1 (0.42) | BRD4MAPTALDH1A1KDM4EMIF | |
| SCHEMBL8701154 | 0.72 | PSMB8 (0.43) | BRD4MAPTTDP1ALDH1A1KDM4E | |
| SCHEMBL14081505 | 0.66 | BRD4 (0.49) | BRD4MAPTCYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL29485027 | 0.66 | BRD4 (0.49) | BRD4MAPTCYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL23610040 | 0.66 | BRD4 (0.49) | BRD4MAPTCYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL1602617 | 0.66 | SLC6A2 (0.40) | BRD4MAPTCYP3A4ALDH1A1KMO | |
| SCHEMBL9003879 | 0.66 | BRD4 (0.46) | BRD4MAPTCYP3A4ALDH1A1KDM4E | |
| SCHEMBL31143703 | 0.66 | BRD4 (0.46) | BRD4MAPTCYP3A4ALDH1A1KDM4E | |
| SCHEMBL30392540 | 0.66 | BRD4 (0.46) | BRD4MAPTCYP3A4ALDH1A1KDM4E |
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 |