Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.34 |
| ▸ | S1PR2 | O95136 | 2/20 | 0.33 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.33 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.33 |
| ▸ | LIPA | P38571 | 1/20 | 0.33 |
| ▸ | LSS | P48449 | 2/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | GBA1 | P04062 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16765708 | 1.00 | TDP1 (0.40) | TDP1EPHX1ALDH1A1S1PR1S1PR3 | |
| SCHEMBL16765715 | 0.98 | TDP1 (0.41) | TDP1EPHX1ALDH1A1S1PR1S1PR3 | |
| Water SCHEMBL28036000 | 0.93 | EPHX1 (0.35) | TDP1EPHX1ALDH1A1S1PR1S1PR3 | |
| SCHEMBL16767016 | 0.92 | TDP1 (0.45) | TDP1CYP1A2 | |
| SCHEMBL19263000 | 0.92 | TDP1 (0.45) | TDP1CYP1A2 | |
| Water SCHEMBL28822891 | 0.91 | TDP1 (0.36) | TDP1EPHX1ALDH1A1S1PR1S1PR3 | |
| SCHEMBL548102 | 0.89 | EPHX1 (0.39) | EPHX1ALDH1A1S1PR1S1PR3S1PR2 | |
| SCHEMBL16765904 | 0.84 | CA1 (0.34) | TDP1CYP19A1 | |
| SCHEMBL16766423 | 0.80 | TDP1 (0.39) | TDP1EPHX1ALDH1A1S1PR1S1PR3 | |
| SCHEMBL16766402 | 0.80 | TDP1 (0.39) | TDP1EPHX1ALDH1A1S1PR1S1PR3 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104710283-B | Cyclopentanol compound | 国际香料和香精公司 | 2019-06-11 | — | — | CN | disclosed |
| US-9701925-B2 | Cyclopentanol compounds | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2017-07-11 | — | — | US | disclosed |
| US-20160160152-A1 | NOVEL CYCLOPENTANOL COMPOUNDS | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2016-06-09 | — | — | US | disclosed |
| US-9290718-B2 | Cyclopentanol compounds | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2016-03-22 | — | — | US | disclosed |
| EP-2902468-A2 | Novel cyclopentanol compounds | International Flavors & Fragrances Inc. (US) | 2015-08-05 | — | — | EP | disclosed |
| CN-104710283-A | Novel cyclopentanol compounds | INT FLAVORS & FRAGRANCES INC | 2015-06-17 | — | — | CN | disclosed |
| US-20150159118-A1 | NOVEL CYCLOPENTANOL COMPOUNDS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2015-06-11 | — | — | US | disclosed |