Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 7/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | IKBKB | O14920 | 4/20 | 0.34 |
| ▸ | CHUK | O15111 | 4/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MGAM | O43451 | 1/20 | 0.34 |
| ▸ | SI | P14410 | 1/20 | 0.34 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4357822 | 0.90 | TRPA1 (0.40) | SMN1; SMN2TRPA1MAPTCES2GAA | |
| SCHEMBL4345893 | 0.80 | SMN1; SMN2 (0.42) | SMN1; SMN2MAPTNPSR1CES2TP53 | |
| SCHEMBL4199192 | 0.79 | SMN1; SMN2 (0.48) | SMN1; SMN2MAPTNPSR1CES2TP53 | |
| SCHEMBL4236185 | 0.74 | SMN1; SMN2 (0.67) | SMN1; SMN2MAPTNPSR1GAAMEN1 | |
| SCHEMBL4242353 | 0.74 | SMN1; SMN2 (0.50) | SMN1; SMN2MAPTNPSR1GAAMEN1 | |
| SCHEMBL4241365 | 0.74 | SMN1; SMN2 (0.48) | SMN1; SMN2MAPTNPSR1CES2GAA | |
| SCHEMBL4195763 | 0.74 | SMN1; SMN2 (0.48) | SMN1; SMN2MAPTNPSR1GAAKDM4E | |
| SCHEMBL4233963 | 0.74 | SMN1; SMN2 (0.48) | SMN1; SMN2MAPTNPSR1TP53GAA | |
| SCHEMBL4201369 | 0.73 | SMN1; SMN2 (0.44) | SMN1; SMN2MAPTNPSR1CES2TP53 | |
| SCHEMBL4735977 | 0.73 | SMN1; SMN2 (0.48) | SMN1; SMN2MAPTNPSR1TP53GAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090105124-A1 | HETEROCYCLIC MODULATORS OF TGR5 | KALYPSYS, INC. (US) | 2009-04-23 | — | — | US | disclosed |
| US-20090105124-A1 | HETEROCYCLIC MODULATORS OF TGR5 | KALYPSYS, INC. (US) | 2009-04-23 | — | — | US | disclosed |
| US-20090105124-A1 | HETEROCYCLIC MODULATORS OF TGR5 | KALYPSYS, INC. (US) | 2009-04-23 | — | — | US | disclosed |
| WO-2009026241-A1 | HETEROCYCLIC MODULATORS OF TGR5 | KALYPSYS, INC. (US) | 2009-02-26 | — | — | 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-20090105124-A1 | HETEROCYCLIC MODULATORS OF TGR5 | GPBAR1, GPR119, GRK5 | SMN1; SMN2 3183/4885TRPA1 670/4885MAPT 4164/4885 |
“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.