Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | BACE1 | P56817 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | NCK1 | P16333 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12323 | 0.84 | BACE1 (0.58) | CYP2A6CYP1A2BACE1TDP1MAPT | |
| SCHEMBL16471396 | 0.84 | MAPT (0.50) | CYP2A6CYP1A2BACE1TDP1MAPT | |
| SCHEMBL17795981 | 0.81 | CYP2A6 (0.52) | CYP2A6CYP1A2BACE1TDP1MAPT | |
| SCHEMBL18407859 | 0.79 | BACE1 (0.43) | BACE1ALDH1A1TP53SMN1; SMN2CYP3A4 | |
| SCHEMBL17934649 | 0.78 | BACE1 (0.50) | CYP2A6BACE1TDP1MAPTRAB9A | |
| SCHEMBL4428302 | 0.77 | BACE1 (0.50) | CYP2A6BACE1ALDH1A1TP53SMN1; SMN2 | |
| SCHEMBL4424142 | 0.75 | BACE1 (0.48) | BACE1 | |
| SCHEMBL6056946 | 0.74 | CYP1A2 (0.87) | CYP2A6CYP1A2BACE1TDP1MAPT | |
| SCHEMBL2463834 | 0.74 | CYP1A2 (0.87) | CYP2A6CYP1A2BACE1TDP1MAPT | |
| SCHEMBL4368477 | 0.74 | CYP1A2 (0.87) | CYP2A6CYP1A2BACE1TDP1MAPT |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3551635-B1 | THIENO-INDENO-MONOMERS AND POLYMERS | BASF SE (DE) | 2021-04-28 | — | — | EP | disclosed |
| EP-3166949-B1 | THIENOTHIOPHENE-ISOINDIGO | CLAP CO LTD (KR) | 2021-02-17 | — | — | EP | disclosed |
| WO-2020078815-A1 | INDACENO DERIVATIVES AS ORGANIC SEMICONDUCTORS | BASF SE (DE) | 2020-04-23 | — | — | WO | disclosed |
| EP-3386989-B1 | NAPHTHOINDACENODITHIOPHENES AND POLYMERS | BASF SE (DE) | 2019-10-23 | — | — | EP | disclosed |
| WO-2018104367-A2 | THIENO-INDENO-MONOMERS AND POLYMERS | BASF SE (DE) | 2018-06-14 | — | — | WO | disclosed |
| WO-2017097924-A1 | NAPHTHOINDACENODITHIOPHENES AND POLYMERS | BASF SE (DE) | 2017-06-15 | — | — | WO | disclosed |