Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 15/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.67 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.67 |
| ▸ | BCL2 | P10415 | 2/20 | 0.60 |
| ▸ | ALB | P02768 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL6430294 | 0.87 | ALDH1A1 (0.57) | MCL1KDM4EALDH1A1FOLH1GAA | |
| SCHEMBL7851128 | 0.86 | MCL1 (0.60) | MCL1KDM4EALDH1A1FOLH1BCL2 | |
| SCHEMBL9449444 | 0.85 | KDM4E (0.81) | MCL1KDM4EALDH1A1FOLH1BCL2 | |
| SCHEMBL5971268 | 0.84 | KDM4E (0.68) | MCL1KDM4EALDH1A1FOLH1BCL2 | |
| SCHEMBL3276610 | 0.84 | KDM4E (0.83) | MCL1KDM4EALDH1A1FOLH1BCL2 | |
| SCHEMBL1093663 | 0.83 | KDM4E (0.67) | MCL1KDM4EALDH1A1FOLH1GAA | |
| SCHEMBL9449326 | 0.82 | MCL1 (0.63) | MCL1KDM4EALDH1A1FOLH1BCL2 | |
| SCHEMBL5955774 | 0.81 | ALDH1A1 (0.74) | MCL1KDM4EALDH1A1FOLH1BCL2 | |
| SCHEMBL29048122 | 0.81 | KDM4E (0.51) | MCL1KDM4EALDH1A1FOLH1GAA | |
| SCHEMBL2362152 | 0.81 | KDM4E (0.53) | MCL1KDM4EALDH1A1FOLH1GAA |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1678134-B1 | PREPARATION OF 4,5-DIALKYL-3-ACYL-PYRROLE-2-CARBOXYLIC ACID DERIVATIVES BY FISCHER-FINK TYPE SYNTHESIS AND SUBSEQUENT ACYLATION | VERTEX PHARMA (US) | 2009-09-09 | — | — | EP | disclosed |
| US-7396940-B2 | Combinatorial library of 3-aryl-1H-indole-2-carboxylic acid | HOFFMANN-LA ROCHE INC. (US) | 2008-07-08 | — | — | US | disclosed |
| US-7396940-B2 | Combinatorial library of 3-aryl-1H-indole-2-carboxylic acid | HOFFMANN-LA ROCHE INC. (US) | 2008-07-08 | — | — | US | disclosed |
| WO-2005040111-A2 | COMBINATORIAL LIBRARY OF 3-ARYL-1H-INDOLE-2-CARBOXYLIC ACIDS | F. HOFFMANN-LA ROCHE AG (DE) | 2005-05-06 | — | — | WO | disclosed |
| WO-2005040073-A2 | SOLID PHASE SYNTHESIS OF 3-ARYL-2- INDOLYLCARBOXYLIC ACIDS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-05-06 | — | — | WO | disclosed |
| US-20050089935-A1 | Combinatorial library of 3-aryl-1h-indole-2-carboxylic acid | CAI JIANPING (US) | 2005-04-28 | — | — | US | disclosed |
| US-20050089935-A1 | Combinatorial library of 3-aryl-1h-indole-2-carboxylic acid | CAI JIANPING (US) | 2005-04-28 | — | — | US | disclosed |
| EP-0800389-A4 | NOVEL COMPOUNDS | SMITHKLINE BEECHAM CORP (US) | 1998-04-29 | — | — | EP | disclosed |
| US-5684032-A | ANTIINFLAMMATORY AGENTS, ANTIARTHRITIC, ANTIASTHMATIC AGENTS AND RESPIRATORY DISORDERS | SMITHKLINE BEECHAM CORPORATION (US) | 1997-11-04 | — | — | US | disclosed |
| EP-0800389-A1 | NOVEL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 1997-10-15 | — | — | EP | disclosed |
| WO-1996018393-A1 | NOVEL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 1996-06-20 | — | — | WO | 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 (1 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-20050089935-A1 | Combinatorial library of 3-aryl-1h-indole-2-carboxylic acid | AADAC, KYNU, DDC | MCL1 1912/4885KDM4E 3666/4885ALDH1A1 253/4885 |
“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.