Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20988270 | 0.82 | ALDH1A1 (0.45) | ALDH1A1CHRNB2CHRNB4CHRNA4KDM4E | |
| SCHEMBL12448116 | 0.81 | CHRNB2 (0.45) | ALDH1A1CHRNB2CHRNB4CHRNA4HTT | |
| SCHEMBL23513804 | 0.77 | KDM4E (0.41) | ALDH1A1KDM4EHTTTDP1MMP1 | |
| SCHEMBL11165110 | 0.77 | TSHR (0.44) | ALDH1A1KDM4EGAAHTTTDP1 | |
| Hydrochloric Acid SCHEMBL6415392 | 0.75 | KDM4E (0.41) | ALDH1A1KDM4EGAAHTTTDP1 | |
| SCHEMBL19090743 | 0.75 | KDM4E (0.37) | ALDH1A1KDM4EGAAHTTTDP1 | |
| SCHEMBL3987200 | 0.74 | GAA (0.46) | ALDH1A1KDM4EGAAHTTTDP1 | |
| SCHEMBL3542942 | 0.73 | LMNA (0.40) | ALDH1A1KDM4EGAAHTTTDP1 | |
| SCHEMBL19090775 | 0.73 | TSHR (0.48) | ALDH1A1KDM4EHTTTDP1TSHR | |
| SCHEMBL4916951 | 0.69 | KDM4E (0.41) | ALDH1A1KDM4EHTTTDP1TSHR |
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-10246478-B2 | Polyene macrolide derivative | SHIONOGI & CO., LTD. (JP) | 2019-04-02 | — | — | US | disclosed |
| US-20170190729-A1 | POLYENE MACROLIDE DERIVATIVE | SHIONOGI & CO., LTD. (JP) | 2017-07-06 | — | — | 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 (2 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-20170190729-A1 | POLYENE MACROLIDE DERIVATIVE | ERG28, RPL23, RPL10 | ALDH1A1 4446/4885CHRNB2 4825/4885CHRNB4 4688/4885 |
| US-10246478-B2 | Polyene macrolide derivative | ERG28, RPL23, RPL10 | ALDH1A1 4446/4885CHRNB2 4825/4885CHRNB4 4688/4885 |
“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.