Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 8/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1964698 | 0.96 | S1PR1 (0.73) | S1PR1ALDH1A1HSD17B10MAPTS1PR3 | |
| SCHEMBL1963865 | 0.94 | S1PR1 (0.57) | S1PR1ALDH1A1HSD17B10S1PR3CYP1A2 | |
| SCHEMBL1968031 | 0.89 | S1PR1 (0.61) | S1PR1ALDH1A1HSD17B10S1PR3KDM4E | |
| SCHEMBL1968240 | 0.88 | S1PR1 (0.67) | S1PR1ALDH1A1HSD17B10S1PR3KDM4E | |
| SCHEMBL1964380 | 0.88 | S1PR1 (0.58) | S1PR1ALDH1A1HSD17B10S1PR3KDM4E | |
| SCHEMBL1965511 | 0.86 | S1PR1 (0.58) | S1PR1ALDH1A1HSD17B10S1PR3CYP1A2 | |
| SCHEMBL1966814 | 0.84 | S1PR1 (0.63) | S1PR1ALDH1A1HSD17B10S1PR3KDM4E | |
| SCHEMBL1489001 | 0.82 | S1PR1 (0.51) | S1PR1ALDH1A1HSD17B10S1PR3CYP1A2 | |
| SCHEMBL1489212 | 0.81 | S1PR1 (0.51) | S1PR1ALDH1A1HSD17B10S1PR3CYP1A2 | |
| SCHEMBL12386199 | 0.81 | NPC1 (0.58) | S1PR1ALDH1A1HSD17B10MAPTCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2334670-A1 | NEW 2-AMIDOTHIADIAZOLE DERIVATIVES | Almirall S.A. (ES) | 2011-06-22 | — | — | EP | claimed |
| WO-2010043377-A1 | NEW 2-AMIDOTHIADIAZOLE DERIVATIVES | ALMIRALL, S.A. (ES) | 2010-04-22 | — | — | WO | claimed |