Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABBR2 | O75899 | 1/20 | 0.64 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.64 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 10/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2826352 | 1.00 | GABBR2 (0.64) | GABBR2GABBR1GPR84PDK2NPC1 | |
| SCHEMBL2826349 | 1.00 | GABBR2 (0.64) | GABBR2GABBR1GPR84PDK2NPC1 | |
| SCHEMBL2834138 | 0.92 | GABBR2 (0.56) | GABBR2GABBR1GPR84PDK2NPC1 | |
| SCHEMBL2371842 | 0.79 | GABBR2 (1.00) | GABBR2GABBR1 | |
| SCHEMBL2371840 | 0.79 | GABBR2 (1.00) | GABBR2GABBR1 | |
| SCHEMBL2371847 | 0.79 | GABBR2 (1.00) | GABBR2GABBR1 | |
| SCHEMBL30618192 | 0.79 | GABBR2 (1.00) | GABBR2GABBR1 | |
| SCHEMBL4598293 | 0.73 | GABBR2 (0.46) | GABBR2GABBR1PDK2 | |
| SCHEMBL2828609 | 0.73 | GABBR2 (0.81) | GABBR2GABBR1NPC1ALDH1A1RAB9A | |
| SCHEMBL2829154 | 0.68 | GABBR2 (0.74) | GABBR2GABBR1PDK2ALDH1A1PTGS1 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1915357-B1 | 2-HYDROXY-PROPIONIC ACID DERIVATIVES AND 3-HYDROXY-BENZOFURAN-2-ONE DERIVATIVES WITH AFFINITY FOR THE GABA-B-RECEPTOR | HOFFMANN LA ROCHE (CH) | 2010-09-08 | — | — | EP | claimed |
| US-7504428-B2 | 2-phenyl-3,3,3-trifluoro-2-hydroxy-propionic acid derivatives | HOFFMAN-LA ROCHE INC. (US) | 2009-03-17 | — | — | US | claimed |
| US-20080234356-A1 | 2-PHENYL-3,3,3-TRIFLUORO-2-HYDROXY-PROPIONIC ACID DERIVATIVES | MALHERBE PARICHEHR | 2008-09-25 | — | — | US | claimed |
| US-20070027204-A1 | 2-phenyl-3,3,3-trifluoro-2-hydroxy-propionic acid derivatives | F. HOFFMANN-LA ROCHE AG, A SWISS COMPANY (CH) | 2007-02-01 | — | — | US | claimed |
| EP-1915357-B1 | 2-HYDROXY-PROPIONIC ACID DERIVATIVES AND 3-HYDROXY-BENZOFURAN-2-ONE DERIVATIVES WITH AFFINITY FOR THE GABA-B-RECEPTOR | HOFFMANN LA ROCHE (CH) | 2010-09-08 | — | — | EP | disclosed |
| US-7504428-B2 | 2-phenyl-3,3,3-trifluoro-2-hydroxy-propionic acid derivatives | HOFFMAN-LA ROCHE INC. (US) | 2009-03-17 | — | — | US | disclosed |
| US-20080234356-A1 | 2-PHENYL-3,3,3-TRIFLUORO-2-HYDROXY-PROPIONIC ACID DERIVATIVES | MALHERBE PARICHEHR | 2008-09-25 | — | — | US | disclosed |
| US-7396853-B2 | 2-phenyl-3,3,3-trifluoro-2-hydroxy-propionic acid derivatives | HOFFMANN-LA ROCHE INC. (US) | 2008-07-08 | — | — | US | disclosed |
| US-20070027204-A1 | 2-phenyl-3,3,3-trifluoro-2-hydroxy-propionic acid derivatives | F. HOFFMANN-LA ROCHE AG, A SWISS COMPANY (CH) | 2007-02-01 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20070027204-A1 | 2-phenyl-3,3,3-trifluoro-2-hydroxy-propionic acid derivatives | GABRA3, GABRA2, GABRA1 | GABBR2 6/4885GABBR1 4/4885GPR84 244/4885 |
| US-20080234356-A1 | 2-PHENYL-3,3,3-TRIFLUORO-2-HYDROXY-PROPIONIC ACID DERIVATIVES | GABBR1, GABRA2, GABRA3 | GABBR2 5/4885GABBR1 1/4885GPR84 203/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.