Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 3/20 | 0.56 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.53 |
| ▸ | MMP1 | P03956 | 5/20 | 0.49 |
| ▸ | MMP2 | P08253 | 5/20 | 0.49 |
| ▸ | MMP9 | P14780 | 5/20 | 0.49 |
| ▸ | EGFR | P00533 | 4/20 | 0.49 |
| ▸ | MAOA | P21397 | 2/20 | 0.49 |
| ▸ | MAOB | P27338 | 2/20 | 0.49 |
| ▸ | NPY5R | Q15761 | 3/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | RORC | P51449 | 1/20 | 0.47 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL17434314 | 1.00 | DHFR (0.56) | DHFRMCHR1MMP1MMP2MMP9 | |
| SCHEMBL4726991 | 0.85 | NPSR1 (0.66) | NPY5RKDM4EALDH1A1MAPTNPSR1 | |
| SCHEMBL4726995 | 0.85 | NPSR1 (0.66) | NPY5RKDM4EALDH1A1MAPTNPSR1 | |
| SCHEMBL17433948 | 0.85 | RORC (0.51) | NPY5RKDM4EALDH1A1MAPTNPSR1 | |
| SCHEMBL17433946 | 0.85 | RORC (0.51) | NPY5RKDM4EALDH1A1MAPTNPSR1 | |
| SCHEMBL17434226 | 0.82 | RORC (0.53) | NPY5RKDM4EALDH1A1MAPTNPSR1 | |
| SCHEMBL17434228 | 0.82 | RORC (0.53) | NPY5RKDM4EALDH1A1MAPTNPSR1 | |
| SCHEMBL19669660 | 0.73 | PARG (0.51) | NPY5RKDM4EALDH1A1MAPTNPSR1 | |
| SCHEMBL17434372 | 0.73 | RORC (0.58) | NPY5RKDM4EALDH1A1MAPTRORC | |
| SCHEMBL17434030 | 0.72 | RORC (0.71) | NPY5RKDM4EALDH1A1MAPTRORC |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9834520-B2 | Heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2017-12-05 | — | — | US | disclosed |
| US-20160229814-A1 | HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-08-11 | — | — | US | disclosed |
| EP-2975031-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2016-01-20 | — | — | EP | 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-20160229814-A1 | HETEROCYCLIC COMPOUND | RORB, RORC, RORA | DHFR 489/4885MCHR1 754/4885MMP1 4106/4885 |
“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.