Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.68 |
| ▸ | PRKCI | P41743 | 1/20 | 0.50 |
| ▸ | KDM1A | O60341 | 2/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.42 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.42 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.42 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.41 |
| ▸ | WNT3A | P56704 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30344379 | 1.00 | TSHR (0.68) | TSHRPRKCIKDM1AHSP90AA1NOTUM | |
| SCHEMBL28332240 | 0.91 | TSHR (0.62) | TSHRPRKCIKDM1ANPC1RAB9A | |
| Hydrogen Sulfide SCHEMBL27600189 | 0.90 | TSHR (0.60) | TSHRPRKCIKDM1APIK3CANPC1 | |
| SCHEMBL2176489 | 0.85 | PRKCI (0.69) | TSHRPRKCINPC1RAB9ACTNNB1 | |
| SCHEMBL29503137 | 0.85 | PRKCI (0.69) | TSHRPRKCINPC1RAB9ACTNNB1 | |
| SCHEMBL4685014 | 0.85 | ALDH1A1 (0.55) | TSHRPRKCINPC1RAB9AKDM4E | |
| SCHEMBL19932401 | 0.84 | TSHR (0.47) | TSHRPRKCINPC1RAB9ACTNNB1 | |
| SCHEMBL1182047 | 0.84 | KDM4E (0.60) | TSHRPRKCINPC1RAB9ACTNNB1 | |
| Hydrochloric Acid SCHEMBL28130087 | 0.84 | PRKCI (0.67) | TSHRPRKCINPC1RAB9ACTNNB1 | |
| SCHEMBL624490 | 0.81 | TSHR (1.00) | TSHRNPC1CASP3RAB9ASMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107001362-A | Heteroaryl compound as BTK inhibitor and application thereof | 默克专利有限公司 | 2017-08-01 | — | — | CN | disclosed |
| WO-2016156872-A1 | QUINOLINE DERIVATIVES AS INHIBITORS OF HEAT SHOCK FACTOR 1 PATHWAY ACTIVITY | CANCER RESEARCH TECHNOLOGY LIMITED (GB) | 2016-10-06 | — | — | WO | disclosed |
| US-20090311217-A1 | 3-SUBSTITUTED-1H-INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES | WYETH (US) | 2009-12-17 | — | — | 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-20090311217-A1 | 3-SUBSTITUTED-1H-INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES | MTOR, RICTOR, PDPK1 | TSHR 3312/4885PRKCI 472/4885KDM1A 1038/4885 |
“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.