Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.67 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.67 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.67 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.67 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.67 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.67 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.67 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.67 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | PGR | P06401 | 8/20 | 0.52 |
| ▸ | PFKFB3 | Q16875 | 2/20 | 0.52 |
| ▸ | PFKFB4 | Q16877 | 1/20 | 0.52 |
| ▸ | PTPN2 | P17706 | 3/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.48 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.48 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.48 |
| ▸ | CCR9 | P51686 | 2/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL17506992 | 0.87 | CYP3A4 (0.56) | CYP3A4CYP2D6PSEN1PSEN2APH1B | |
| SCHEMBL17491543 | 0.87 | CYP3A4 (0.56) | CYP3A4CYP2D6PSEN1PSEN2APH1B | |
| SCHEMBL17491479 | 0.87 | PGR (0.59) | CYP3A4CYP2D6PSEN1PSEN2APH1B | |
| SCHEMBL24913589 | 0.80 | CYP3A4 (1.00) | CYP3A4CYP2D6PSEN1PSEN2APH1B | |
| SCHEMBL17491433 | 0.77 | CYP3A4 (0.47) | CYP3A4CYP2D6PSEN1PSEN2APH1B | |
| SCHEMBL17491381 | 0.75 | NPC1 (0.57) | KMT2APKMLMNA | |
| SCHEMBL788034 | 0.74 | PFKFB3 (0.63) | CYP3A4CYP2D6PSEN1PSEN2APH1B | |
| SCHEMBL18394452 | 0.74 | MEN1 (0.64) | CYP3A4CYP2D6PSEN1PSEN2APH1B | |
| SCHEMBL12368209 | 0.73 | KMT2A (1.00) | CYP3A4CYP2D6PSEN1PSEN2APH1B | |
| SCHEMBL788132 | 0.73 | PFKFB3 (0.59) | CYP3A4CYP2D6PSEN1PSEN2APH1B |
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 |
|---|---|---|---|---|---|---|---|
| EP-2982670-B1 | HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2018-11-07 | — | — | EP | disclosed |
| US-9624184-B2 | Heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2017-04-18 | — | — | US | disclosed |
| US-9624184-B2 | Heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2017-04-18 | — | — | US | disclosed |
| US-9624184-B2 | Heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2017-04-18 | — | — | US | disclosed |
| US-20160052897-A1 | HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-02-25 | — | — | US | disclosed |
| EP-2982670-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2016-02-10 | — | — | 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-20160052897-A1 | HETEROCYCLIC COMPOUND | PSEN1, PSEN2, BACE1 | CYP3A4 315/4885CYP2D6 94/4885PSEN1 1/4885 |
“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.