Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 4/20 | 0.44 |
| ▸ | TDP2 | O95551 | 1/20 | 0.41 |
| ▸ | SRD5A1 | P18405 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 2/20 | 0.39 |
| ▸ | KMO | O15229 | 1/20 | 0.39 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3028797 | 1.00 | ALDH1A1 (0.49) | ALDH1A1TDP1SRD5A2TDP2SRD5A1 | |
| SCHEMBL14263744 | 0.81 | CHRNB2 (0.47) | ALDH1A1TDP1SRD5A2SRD5A1KDM4E | |
| SCHEMBL4045891 | 0.81 | CHRNB2 (0.47) | ALDH1A1TDP1SRD5A2SRD5A1KDM4E | |
| SCHEMBL7165102 | 0.77 | ALDH1A1 (0.50) | ALDH1A1TDP1SRD5A2TDP2SRD5A1 | |
| SCHEMBL19718187 | 0.77 | ALDH1A1 (0.53) | ALDH1A1TDP1SRD5A2TDP2SRD5A1 | |
| SCHEMBL1025843 | 0.77 | DRD2 (0.49) | CA1CA2 | |
| SCHEMBL13866811 | 0.77 | DRD2 (0.49) | CA1CA2 | |
| SCHEMBL24214088 | 0.76 | ALDH1A1 (0.49) | ALDH1A1TDP1SRD5A2SRD5A1KDM4E | |
| Hydrochloric Acid SCHEMBL6642375 | 0.75 | ALDH1A1 (0.52) | ALDH1A1TDP1SRD5A2SRD5A1KDM4E | |
| SCHEMBL15443897 | 0.75 | ALDH1A1 (0.47) | ALDH1A1TDP1SRD5A2TDP2SRD5A1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7759492-B2 | Enantioselective synthesis of 13-oxotricyclo[8.2.1.0.3,8] trideca-3(8),4,6-triene-5-carboxylates | MERCK SHARP & DOHME LIMITED (GB) | 2010-07-20 | — | — | US | disclosed |
| US-7759492-B2 | Enantioselective synthesis of 13-oxotricyclo[8.2.1.0.3,8] trideca-3(8),4,6-triene-5-carboxylates | MERCK SHARP & DOHME LIMITED (GB) | 2010-07-20 | — | — | US | disclosed |
| US-20070244329-A1 | Enantioselective Synthesis of 13-Oxotricyclo[8.2.1.0. 3,8] Trideca-3(8),4,6-Triene-5-Carboxylates | MERCK SHARP & DOHME LIMITED (GB) | 2007-10-18 | — | — | US | disclosed |
| CN-101006043-A | Enantioselective synthesis of 13-oxotricyclo[8.2.1.0 3,8]trideca-3(8),4,6-triene-5-carboxylates | MERCK SHARP & DOHME (GB) | 2007-07-25 | — | — | CN | disclosed |
| EP-1781591-A1 | ENANTIOSELECTIVE SYNTHESIS OF 13-OXOTRICYCLO[8.2.1.0 3,8]TRIDECA-3(8),4,6-TRIENE-5-CARBOXYLATES | MERCK SHARP & DOHME LTD. (GB) | 2007-05-09 | — | — | EP | disclosed |
| WO-2006018663-A1 | ENANTIOSELECTIVE SYNTHESIS OF 13-OXOTRICYCLO[8.2.1.0 3,8]TRIDECA-3(8),4,6-TRIENE-5-CARBOXYLATES | MERCK SHARP & DOHME LIMITED (GB) | 2006-02-23 | — | — | 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-20070244329-A1 | Enantioselective Synthesis of 13-Oxotricyclo[8.2.1.0. 3,8] Trideca-3(8),4,6-Triene-5-Carboxylates | CYP8B1, OXER1, CYP2A13 | ALDH1A1 258/4885TDP1 191/4885SRD5A2 53/4885 |
“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.