Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.53 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL1859068 | 0.88 | HSP90AA1 (0.69) | DHFRHTTHSP90AA1HSP90AB1POLB | |
| SCHEMBL1855267 | 0.80 | DHFR (0.53) | DHFRHTTPOLBALDH1A1HPGD | |
| SCHEMBL27648253 | 0.76 | PNP (0.61) | — | |
| SCHEMBL11012896 | 0.74 | DHFR (0.49) | DHFRHTTALDH1A1HPGD | |
| SCHEMBL11831045 | 0.74 | DHFR (0.58) | DHFRHTTALDH1A1HPGD | |
| SCHEMBL28052184 | 0.73 | KMT2A (0.44) | DHFRHTTPOLBENPP1ALDH1A1 | |
| Alcohol SCHEMBL28116206 | 0.73 | PNP (0.54) | — | |
| SCHEMBL11006578 | 0.72 | DHFR (0.71) | DHFRHTT | |
| SCHEMBL11757871 | 0.71 | DHFR (0.58) | DHFRHTTALDH1A1HPGD | |
| SCHEMBL5356890 | 0.71 | DHFR (0.70) | DHFRHTT |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210323965-A1 | SMALL-MOLECULE HSP90 INHIBITORS | SLOAN KETTERING INST CANCER RES (US) | 2021-10-21 | — | — | US | disclosed |
| US-20200385389-A1 | SMALL-MOLECULE HSP90 INHIBITORS | SLOAN KETTERING INST CANCER RES (US) | 2020-12-10 | — | — | US | disclosed |
| US-10676476-B2 | Small-molecule HSP90 inhibitors | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2020-06-09 | — | — | US | disclosed |
| US-20190023708-A1 | SMALL-MOLECULE HSP90 INHIBITORS | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH | 2019-01-24 | — | — | US | disclosed |
| US-10167285-B2 | Small-molecule HSP90 inhibitors | MEMORIAL SLOAN KETTERING CANCER CENTER (US) | 2019-01-01 | — | — | US | disclosed |
| US-10000494-B2 | Small-molecule Hsp90 inhibitors | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2018-06-19 | — | — | US | disclosed |
| US-20170342073-A1 | SMALL-MOLECULE HSP90 INHIBITORS | MEMORIAL SLOAN KETTERING CANCER CENTER | 2017-11-30 | — | — | US | disclosed |
| US-9701678-B2 | Small-molecule HSP90 inhibitors | MEMORIAL SLOAN KETTERING CANCER CENTER (US) | 2017-07-11 | — | — | US | disclosed |
| US-20160333014-A1 | SMALL-MOLECULE HSP90 INHIBITORS | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH | 2016-11-17 | — | — | US | disclosed |
| US-9403828-B2 | Small-molecule Hsp90 inhibitors | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2016-08-02 | — | — | US | disclosed |
| US-20140227183-A1 | SMALL-MOLECULE HSP90 INHIBITORS | MEMORIAL SLOAN KETTERING CANCER CENTER (US) | 2014-08-14 | — | — | US | disclosed |
| US-8703942-B2 | Small-molecule Hsp90 inhibitors | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2014-04-22 | — | — | US | disclosed |
| US-20110312980-A1 | Small-molecule Hsp90 Inhibitors | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2011-12-22 | — | — | US | disclosed |
| US-20110104054-A1 | Small-Molecule HSP90 Inhibitors | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2011-05-05 | — | — | US | disclosed |
| US-7834181-B2 | Small-molecule Hsp90 inhibitors | SLAON-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2010-11-16 | — | — | US | disclosed |
| US-20080253965-A1 | Small-Molecule Hsp90 Inhibitors | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2008-10-16 | — | — | US | disclosed |
| WO-2006084030-A2 | SMALL-MOLECULE HSP90 INHIBITORS | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2006-08-10 | — | — | WO | 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 (12 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-20200385389-A1 | SMALL-MOLECULE HSP90 INHIBITORS | HSP90B1, HSP90AB1, HSP90AB2P | DHFR 1398/4885HTT 2146/4885HSP90AA1 4/4885 |
| US-20170342073-A1 | SMALL-MOLECULE HSP90 INHIBITORS | HSP90B1, HSP90AB2P, HSP90AB1 | DHFR 3669/4885HTT 197/4885HSP90AA1 4/4885 |
| US-10000494-B2 | Small-molecule Hsp90 inhibitors | HSP90B1, HSP90AB1, HSP90AB2P | DHFR 1398/4885HTT 2146/4885HSP90AA1 4/4885 |
| US-20110104054-A1 | Small-Molecule HSP90 Inhibitors | HSP90AB2P, HSP90AB1, HSP90AA1 | DHFR 2890/4885HTT 1205/4885HSP90AA1 3/4885 |
| US-20160333014-A1 | SMALL-MOLECULE HSP90 INHIBITORS | HSP90B1, HSP90AB1, HSP90AB2P | DHFR 1398/4885HTT 2146/4885HSP90AA1 4/4885 |
| US-20190023708-A1 | SMALL-MOLECULE HSP90 INHIBITORS | HSP90B1, HSP90AB1, HSP90AB2P | DHFR 1398/4885HTT 2146/4885HSP90AA1 4/4885 |
| US-10167285-B2 | Small-molecule HSP90 inhibitors | HSP90B1, HSP90AB2P, HSP90AB1 | DHFR 3674/4885HTT 190/4885HSP90AA1 4/4885 |
| US-20140227183-A1 | SMALL-MOLECULE HSP90 INHIBITORS | HSP90AB2P, HSP90AB1, HSP90B1 | DHFR 2764/4885HTT 1189/4885HSP90AA1 4/4885 |
| US-20080253965-A1 | Small-Molecule Hsp90 Inhibitors | HSP90AB2P, HSP90AB1, HSP90AA1 | DHFR 3078/4885HTT 1022/4885HSP90AA1 3/4885 |
| US-20210323965-A1 | SMALL-MOLECULE HSP90 INHIBITORS | HSP90B1, HSP90AB1, HSP90AB2P | DHFR 1398/4885HTT 2146/4885HSP90AA1 4/4885 |
| US-10676476-B2 | Small-molecule HSP90 inhibitors | HSP90B1, HSP90AB1, HSP90AB2P | DHFR 1398/4885HTT 2146/4885HSP90AA1 4/4885 |
| US-20110312980-A1 | Small-molecule Hsp90 Inhibitors | HSP90B1, HSP90AB1, HSP90AB2P | DHFR 1398/4885HTT 2146/4885HSP90AA1 4/4885 |
“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.