Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | DPP4 | P27487 | 1/20 | 0.44 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 4/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23911666 | 0.81 | AKR1B1 (0.46) | CYP1A2CYP3A4CYP2C19TSHRALDH1A1 | |
| SCHEMBL15495466 | 0.81 | PDK2 (0.53) | CYP1A2CYP3A4CYP2C19TSHRALDH1A1 | |
| SCHEMBL23911670 | 0.81 | NOTUM (0.51) | CYP1A2CYP3A4CYP2C19TSHRALDH1A1 | |
| SCHEMBL9675049 | 0.81 | AKR1B1 (0.48) | CYP1A2CYP3A4CYP2C19TSHRALDH1A1 | |
| SCHEMBL30566770 | 0.81 | AKR1B1 (0.48) | CYP1A2CYP3A4CYP2C19TSHRALDH1A1 | |
| SCHEMBL6979805 | 0.78 | DPP4 (0.57) | CYP1A2CYP3A4CYP2C19TSHRALDH1A1 | |
| SCHEMBL9028248 | 0.77 | NPC1 (0.56) | ALDH1A1MAPK1HSD17B10NPC1MAPT | |
| SCHEMBL23911673 | 0.76 | SMN1; SMN2 (0.53) | CYP1A2CYP3A4CYP2C19TSHRALDH1A1 | |
| SCHEMBL102794 | 0.73 | AKR1B1 (0.45) | CYP1A2CYP3A4CYP2C19TSHRALDH1A1 | |
| SCHEMBL4907998 | 0.73 | NPC1 (0.66) | CYP1A2CYP2C19TSHRS1PR1MAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210317112-A1 | HETEROCYCLIC COMPOUNDS AS PESTICIDES | BAYER AG (DE) | 2021-10-14 | — | — | US | disclosed |
| US-20210317112-A1 | HETEROCYCLIC COMPOUNDS AS PESTICIDES | BAYER AG (DE) | 2021-10-14 | — | — | US | 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-20210317112-A1 | HETEROCYCLIC COMPOUNDS AS PESTICIDES | DDT, ACHE, PTMS | CYP1A2 65/4885CYP3A4 56/4885CYP2C19 200/4885 |
“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.