Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | PI4KA | P42356 | 5/20 | 0.38 |
| ▸ | PI4K2B | Q8TCG2 | 5/20 | 0.38 |
| ▸ | PI4K2A | Q9BTU6 | 5/20 | 0.38 |
| ▸ | PI4KB | Q9UBF8 | 5/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.37 |
| ▸ | PRKDC | P78527 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16487461 | 0.84 | HSP90B1 (0.47) | MAP4K4ERBB2HSP90AA1HSP90AB1LMNA | |
| SCHEMBL16486560 | 0.82 | TYMS (0.46) | ERBB2HSP90AA1HSP90AB1PI4KAPI4K2B | |
| SCHEMBL28068959 | 0.82 | HSP90AA1 (0.38) | MAP4K4KDM4EERBB2HSP90AA1HSP90AB1 | |
| SCHEMBL13050401 | 0.82 | HSP90AA1 (0.42) | MAP4K4KDM4EERBB2HSP90AA1HSP90AB1 | |
| SCHEMBL5132695 | 0.81 | LMNA (0.48) | MAP4K4ALDH1A1PI4KAPI4K2BPI4K2A | |
| SCHEMBL14467034 | 0.80 | ERBB2 (0.41) | MAP4K4ERBB2HSP90AA1HSP90AB1 | |
| SCHEMBL1669646 | 0.80 | ERBB2 (0.40) | MAP4K4KDM4EALDH1A1ERBB2HSP90AA1 | |
| SCHEMBL12454385 | 0.80 | ALDH1A1 (0.42) | KDM4EALDH1A1MEN1MAPTSTAT3 | |
| SCHEMBL16486451 | 0.79 | HSP90B1 (0.44) | MAP4K4KDM4EERBB2HSP90AA1HSP90AB1 | |
| SCHEMBL16487160 | 0.78 | HSP90AA1 (0.45) | MAP4K4ERBB2HSP90AA1HSP90AB1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-9926321-B2 | Hsp90 inhibitors | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2018-03-27 | — | — | US | disclosed |
| US-20160310497-A1 | PURINE DERIVATIVES USEFUL AS HSP90 INHIBITORS | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH | 2016-10-27 | — | — | US | disclosed |
| US-20160264577-A1 | HSP90 INHIBITORS | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH | 2016-09-15 | — | — | US | disclosed |
| US-9346808-B2 | Hsp90 inhibitors | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2016-05-24 | — | — | US | disclosed |
| US-9328114-B2 | Hsp90 inhibitors | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2016-05-03 | — | — | US | disclosed |
| US-20120208806-A1 | Hsp90 Inhibitors | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2012-08-16 | — | — | 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 (3 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-20160264577-A1 | HSP90 INHIBITORS | HSP90AB1, HSP90B1, HSP90AB2P | MAP4K4 991/4885KDM4E 3174/4885ALDH1A1 4061/4885 |
| US-20120208806-A1 | Hsp90 Inhibitors | HSP90B1, HSP90AB1, HSP90AB2P | MAP4K4 1838/4885KDM4E 4277/4885ALDH1A1 2794/4885 |
| US-20160310497-A1 | PURINE DERIVATIVES USEFUL AS HSP90 INHIBITORS | XDH, HSP90B1, HSP90AA1 | MAP4K4 2289/4885KDM4E 3517/4885ALDH1A1 1795/4885 |
“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.