Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | CNR2 | P34972 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | CAPN9 | O14815 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | TDP2 | O95551 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28525814 | 0.99 | ALDH1A1 (0.56) | ALDH1A1CNR2CYP3A4TDP1CAPN9 | |
| SCHEMBL28524830 | 0.79 | CYP3A4 (0.53) | ALDH1A1CYP3A4TDP1CAPN9CASP3 | |
| SCHEMBL29634212 | 0.79 | CYP3A4 (0.53) | ALDH1A1CYP3A4TDP1CAPN9CASP3 | |
| SCHEMBL28523381 | 0.78 | ALDH1A1 (0.64) | ALDH1A1CNR2TDP1MEN1KMT2A | |
| SCHEMBL29770999 | 0.76 | ALDH1A1 (0.61) | ALDH1A1CNR2TDP1MEN1KMT2A | |
| SCHEMBL8130642 | 0.75 | CYP3A4 (0.48) | ALDH1A1CYP3A4TDP1CAPN9CASP3 | |
| SCHEMBL28520051 | 0.75 | CYP3A4 (0.48) | ALDH1A1CYP3A4TDP1CAPN9CASP3 | |
| SCHEMBL29634204 | 0.75 | CYP3A4 (0.48) | ALDH1A1CYP3A4TDP1CAPN9CASP3 | |
| SCHEMBL11103515 | 0.75 | KDM4E (0.63) | ALDH1A1CYP3A4TDP1MEN1KMT2A | |
| SCHEMBL7508014 | 0.74 | ALDH1A1 (1.00) | ALDH1A1CNR2TDP1MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022160138-A1 | BENZOXAZINE-4-ONE COMPOUND, PREPARATION METHOD THEREFOR, AND MEDICAL USE THEREOF | 承德医学院 | 2022-08-04 | — | — | WO | disclosed |
| CN-112442022-B | Benzoxazine-4-ketone compound, preparation method and medical application thereof | 承德医学院 | 2022-05-20 | — | — | CN | disclosed |
| CN-112442022-A | Benzoxazine-4-ketone compound, preparation method and medical application thereof | 承德医学院 | 2021-03-05 | — | — | CN | disclosed |