Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 6/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21701876 | 0.99 | CYP1A2 (0.43) | CYP1A2CYP3A4MEN1ALDH1A1KMT2A | |
| SCHEMBL21701608 | 0.96 | CYP1A2 (0.38) | CYP1A2CYP3A4MEN1ALDH1A1KMT2A | |
| SCHEMBL21701589 | 0.96 | CYP1A2 (0.38) | CYP1A2CYP3A4MEN1ALDH1A1KMT2A | |
| SCHEMBL21701604 | 0.95 | CYP1A2 (0.37) | CYP1A2CYP3A4MEN1ALDH1A1KMT2A | |
| SCHEMBL21701884 | 0.95 | CYP1A2 (0.37) | CYP1A2CYP3A4MEN1ALDH1A1KMT2A | |
| SCHEMBL21701882 | 0.95 | CYP1A2 (0.37) | CYP1A2CYP3A4MEN1ALDH1A1KMT2A | |
| SCHEMBL21701881 | 0.94 | ABCG2 (0.39) | CYP1A2CYP3A4MEN1ALDH1A1KMT2A | |
| SCHEMBL21702227 | 0.93 | ALDH1A3 (0.41) | CYP1A2CYP3A4MEN1ALDH1A1KMT2A | |
| SCHEMBL21701924 | 0.93 | ALDH1A3 (0.42) | CYP1A2CYP3A4MEN1ALDH1A1KMT2A | |
| SCHEMBL21702192 | 0.92 | CYP1A2 (0.36) | CYP1A2CYP3A4MEN1ALDH1A1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20200048230-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT INCLUDING SAME | LG CHEM, LTD. (KR) | 2020-02-13 | — | — | 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-20200048230-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT INCLUDING SAME | CRY1, CRY2, CYP1A1 | CYP1A2 15/4885CYP3A4 22/4885MEN1 319/4885 |
“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.