Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | NPFFR1 | Q9GZQ6 | 1/20 | 0.43 |
| ▸ | NPFFR2 | Q9Y5X5 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21848460 | 0.90 | BACE1 (0.44) | BACE1KDM4EALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL21848545 | 0.81 | ACACA (0.40) | KDM4EMAPT | |
| SCHEMBL21848459 | 0.79 | BACE1 (0.47) | BACE1KDM4EALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL21848468 | 0.79 | BACE1 (0.58) | BACE1KDM4EALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL21848470 | 0.78 | BACE1 (0.46) | BACE1KDM4EALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL21848469 | 0.76 | BACE1 (0.54) | BACE1KDM4EALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL2600753 | 0.75 | CYP1A2 (0.60) | BACE1KDM4EALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL21848463 | 0.74 | EPHX1 (0.44) | BACE1ALDH1A1SMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL18463865 | 0.74 | CYP1A2 (0.55) | BACE1KDM4EALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL21848543 | 0.74 | GPR55 (0.47) | KDM4EALDH1A1SMN1; SMN2HPGDCYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023009072-A2 | COVALENT ORGANIC FRAMEWORK MEMBRANES, METHODS AND USES THEREOF | NATIONAL UNIVERSITY OF SINGAPORE (SG) | 2023-02-02 | — | — | WO | disclosed |
| WO-2020063399-A1 | METHOD FOR LIGHT-INDUCED DECARBOXYLATION COUPLING OF ACTIVE CARBOXYLIC ACID ESTER UNDER NON-METAL CATALYSIS | 中国科学技术大学 | 2020-04-02 | — | — | WO | disclosed |