Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 18/20 | 0.74 |
| ▸ | HSP90AB1 | P08238 | 18/20 | 0.74 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.65 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.65 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.65 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.65 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.65 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.65 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.65 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.65 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.65 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.65 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.65 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.48 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.47 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11909019 | 0.96 | HSP90AA1 (0.67) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL15624901 | 0.88 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL15624961 | 0.88 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL1672476 | 0.88 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL13194029 | 0.87 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL18203476 | 0.87 | HSP90AA1 (0.80) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL15609954 | 0.87 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL15610356 | 0.87 | HSP90AA1 (0.55) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL15624945 | 0.87 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 | |
| SCHEMBL15609826 | 0.87 | HSP90AA1 (0.55) | HSP90AA1HSP90AB1HDAC3HDAC4HDAC1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10172863-B2 | Purine derivatives useful as HSP90 inhibitors | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2019-01-08 | — | — | US | claimed |
| EP-3091019-A2 | PURINE DERIVATIVES USEFUL AS HSP90 INHIBITORS | Sloan Kettering Institute For Cancer Research (US) | 2016-11-09 | — | — | EP | claimed |
| EP-2486039-B1 | PURINE DERIVATIVES USEFUL AS HSP90 INHIBITORS | SLOAN KETTERING INST CANCER (US) | 2016-06-01 | — | — | EP | claimed |
| US-9328114-B2 | Hsp90 inhibitors | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2016-05-03 | — | — | US | claimed |
| US-20120208806-A1 | Hsp90 Inhibitors | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2012-08-16 | — | — | US | claimed |
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-10172863-B2 | Purine derivatives useful as HSP90 inhibitors | XDH, HSP90B1, HSP90AA1 | HSP90AA1 3/4885HSP90AB1 4/4885HDAC3 2902/4885 |
| US-20120208806-A1 | Hsp90 Inhibitors | HSP90B1, HSP90AB1, HSP90AB2P | HSP90AA1 4/4885HSP90AB1 2/4885HDAC3 1153/4885 |
“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.