Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.40 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | UNG | P13051 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.33 |
| ▸ | ABAT | P80404 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 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 | |
|---|---|---|---|---|
| SCHEMBL205804 | 0.79 | BRD4 (0.53) | BRD4TRIM24TRIM33CA12CA1 | |
| SCHEMBL16388683 | 0.78 | ERN1 (0.42) | — | |
| SCHEMBL204537 | 0.77 | BRD4 (0.46) | BRD4TRIM24TRIM33CA12CA1 | |
| SCHEMBL204011 | 0.77 | BRD4 (0.46) | BRD4TRIM24TRIM33CA12CA1 | |
| SCHEMBL16347771 | 0.75 | CNR2 (0.48) | CNR2 | |
| SCHEMBL1974835 | 0.75 | BRD4 (0.55) | BRD4TRIM24TRIM33CA12CA1 | |
| SCHEMBL1745297 | 0.74 | BRD4 (0.58) | BRD4TRIM24TRIM33CA12CA1 | |
| SCHEMBL16388501 | 0.74 | MAOA (0.49) | BRD4RAB9AALDH1A1TDP1MAOA | |
| SCHEMBL16347664 | 0.72 | BRD4 (0.37) | BRD4TRIM24TRIM33 | |
| SCHEMBL205798 | 0.72 | BRD4 (0.53) | BRD4TRIM24TRIM33CA12CA1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104507921-B | Benzocyclobutene derivative and preparation method and pharmaceutical application thereof | 四川海思科制药有限公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-104507921-A | Benzocyclobutene derivative and preparation method and pharmaceutical application thereof | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2015-04-08 | — | — | CN | disclosed |
| WO-2015000412-A1 | BENZOCYCLOBUTENE DERIVATIVE AND PREPARATION METHOD AND PHARMACEUTICAL APPLICATION THEREOF | 四川海思科制药有限公司 (CN) | 2015-01-08 | — | — | WO | disclosed |
| WO-2015000412-A1 | BENZOCYCLOBUTENE DERIVATIVE AND PREPARATION METHOD AND PHARMACEUTICAL APPLICATION THEREOF | 四川海思科制药有限公司 (CN) | 2015-01-08 | — | — | WO | disclosed |