Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 7/20 | 0.40 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.37 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL5171500 | 0.83 | PTGS2 (0.48) | PTGS2ERN1PTGS1 | |
| SCHEMBL9441793 | 0.82 | SMN1; SMN2 (0.46) | ALDH1A1FFAR4PTGS2 | |
| SCHEMBL9857094 | 0.81 | PTGS2 (0.41) | ALDH1A1PTGS2PTGS1TNKS2 | |
| SCHEMBL10913187 | 0.80 | ERN1 (0.34) | ALDH1A1ERN1 | |
| SCHEMBL9441586 | 0.79 | FFAR4 (0.36) | ALDH1A1FFAR4PTGS2PTGS1GRM2 | |
| SCHEMBL6956685 | 0.77 | HMGCR (0.51) | ALDH1A1PTGS2GRM2 | |
| SCHEMBL10743288 | 0.77 | ALKBH3 (0.44) | ALDH1A1PTGS2PTGS1 | |
| SCHEMBL10586450 | 0.75 | TNKS (0.39) | ALDH1A1ERN1TNKS2GRM2 | |
| SCHEMBL28195990 | 0.74 | GRM2 (0.47) | ALDH1A1PTGS2PTGS1GRM2 | |
| SCHEMBL11258939 | 0.73 | PTGS2 (0.43) | ALDH1A1PTGS2ERN1PTGS1 |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0038061-B1 | SUBSTITUTED BIPHENYL-2-CARBOXALDEHYDES AND A PROCESS FOR PREPARING THEM | MERCK & CO. INC. (US) | 1985-01-23 | — | — | EP | claimed |
| US-4322563-A | Substituted biphenyl-2-carboxaldehydes | MERCK & CO., INC. (US) | 1982-03-30 | — | — | US | claimed |
| EP-0038061-A1 | Substituted biphenyl-2-carboxaldehydes and a process for preparing them | MERCK & CO. INC. (US) | 1981-10-21 | — | — | EP | claimed |
| US-5276021-A | Anticholesterol or antilipemic agents | E. R. SQUIBB & SONS, INC. (US) | 1994-01-04 | — | — | US | disclosed |
| US-5091378-A | Anticholesterol agents | E. R. SQUIBB & SONS, INC. (US) | 1992-02-25 | — | — | US | disclosed |
| US-5032590-A | Substituted hydroxylamines | BAYER AKTIENGESELLSCHAFT (DE) | 1991-07-16 | — | — | US | disclosed |
| US-4968681-A | Substituted hydroxylamines | BAYER AKTIENGESELLSCHAFT (DE) | 1990-11-06 | — | — | US | disclosed |
| US-4898868-A | ANTICHOLESTEROL AGENTS; LACTONE OR FREE ACID FORM | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-02-06 | — | — | US | disclosed |
| EP-0317845-A2 | Substituted hydroxyl amines | BAYER AG (DE) | 1989-05-31 | — | — | EP | disclosed |
| US-4620025-A | NICKEL COMPLEX CATALYSTS | MERCK & CO., INC. (US) | 1986-10-28 | — | — | US | disclosed |
| EP-0038061-B1 | SUBSTITUTED BIPHENYL-2-CARBOXALDEHYDES AND A PROCESS FOR PREPARING THEM | MERCK & CO. INC. (US) | 1985-01-23 | — | — | EP | disclosed |
| US-4322563-A | Substituted biphenyl-2-carboxaldehydes | MERCK & CO., INC. (US) | 1982-03-30 | — | — | US | disclosed |
| EP-0038061-A1 | Substituted biphenyl-2-carboxaldehydes and a process for preparing them | MERCK & CO. INC. (US) | 1981-10-21 | — | — | EP | disclosed |