Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 15/20 | 1.00 |
| ▸ | CACNA1I | Q9P0X4 | 14/20 | 1.00 |
| ▸ | CACNA1G | O43497 | 2/20 | 1.00 |
| ▸ | CHRM2 | P08172 | 1/20 | 1.00 |
| ▸ | HRH1 | P35367 | 1/20 | 1.00 |
| ▸ | HTR4 | Q13639 | 1/20 | 1.00 |
| ▸ | CACNA1C | Q13936 | 1/20 | 1.00 |
| ▸ | CACNA1H | O95180 | 6/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL3516161 | 1.00 | KCNH2 (1.00) | KCNH2CACNA1ICACNA1GCHRM2HRH1 | |
| SCHEMBL3515947 | 1.00 | KCNH2 (1.00) | KCNH2CACNA1ICACNA1GCHRM2HRH1 | |
| SCHEMBL3515905 | 1.00 | KCNH2 (1.00) | KCNH2CACNA1ICACNA1GCHRM2HRH1 | |
| SCHEMBL3824642 | 0.94 | CACNA1I (0.89) | KCNH2CACNA1ICACNA1GCHRM2HRH1 | |
| SCHEMBL20328204 | 0.94 | CACNA1I (0.89) | KCNH2CACNA1ICACNA1GCHRM2HRH1 | |
| SCHEMBL8237453 | 0.94 | CACNA1I (0.89) | KCNH2CACNA1ICACNA1GCHRM2HRH1 | |
| SCHEMBL3514784 | 0.94 | CACNA1I (0.89) | KCNH2CACNA1ICACNA1GCHRM2HRH1 | |
| SCHEMBL3515069 | 0.94 | CACNA1I (0.89) | KCNH2CACNA1ICACNA1GCHRM2HRH1 | |
| SCHEMBL3516205 | 0.92 | CACNA1I (0.85) | KCNH2CACNA1ICACNA1GCHRM2HRH1 | |
| SCHEMBL8247891 | 0.92 | CACNA1I (0.85) | KCNH2CACNA1ICACNA1GCHRM2HRH1 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100222387-A1 | 3-Fluoro-Piperidine T-Type Calcium Channel Antagonists | MERCK SHARP & DOHME CORP. | 2010-09-02 | — | — | US | claimed |
| US-20230349886-A1 | SYSTEMS AND METHODS FOR PREDICTING CARDIOTOXICITY OF MOLECULAR PARAMETERS OF A COMPOUND BASED ON MACHINE LEARNING ALGORITHMS | UTI LP (CA) | 2023-11-02 | — | — | US | disclosed |
| US-20210128537-A1 | T-TYPE CALCIUM CHANNEL MODULATORS AND METHODS OF USE THEREOF | PRAXIS PREC MEDICINES INC (US) | 2021-05-06 | — | — | US | disclosed |
| US-20210038589-A1 | USES, COMPOSITIONS AND METHODS | FISAHN ANDRE (SE) | 2021-02-11 | — | — | US | disclosed |
| US-20180172667-A1 | SYSTEMS AND METHODS FOR PREDICTING CARDIOTOXICITY OF MOLECULAR PARAMETERS OF A COMPOUND BASED ON MACHINE LEARNING ALGORITHMS | UTI LP (CA) | 2018-06-21 | — | — | US | disclosed |
| WO-2016201575-A1 | SYSTEMS AND METHODS FOR PREDICTING CARDIOTOXICITY OF MOLECULAR PARAMETERS OF A COMPOUND BASED ON MACHINE LEARNING ALGORITHMS | UTI LIMITED PARTNERSHIP (CA) | 2016-12-22 | — | — | WO | disclosed |
| US-20100222387-A1 | 3-Fluoro-Piperidine T-Type Calcium Channel Antagonists | MERCK SHARP & DOHME CORP. | 2010-09-02 | — | — | US | disclosed |
| US-20100222387-A1 | 3-Fluoro-Piperidine T-Type Calcium Channel Antagonists | MERCK SHARP & DOHME CORP. | 2010-09-02 | — | — | US | disclosed |
| US-20100222387-A1 | 3-Fluoro-Piperidine T-Type Calcium Channel Antagonists | MERCK SHARP & DOHME CORP. | 2010-09-02 | — | — | US | disclosed |
| WO-2007002361-A2 | 3-FLUORO-PIPERIDINE T-TYPE CALCIUM CHANNEL ANTAGONISTS | MERCK & CO., INC. (US) | 2007-01-04 | — | — | 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 (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-20210038589-A1 | USES, COMPOSITIONS AND METHODS | APP, CACNA1G, CACNA1B | KCNH2 98/4885CACNA1I 5/4885CACNA1G 2/4885 |
| US-20100222387-A1 | 3-Fluoro-Piperidine T-Type Calcium Channel Antagonists | CACNA1G, CACNA1I, CACNA1H | KCNH2 35/4885CACNA1I 2/4885CACNA1G 1/4885 |
| US-20210128537-A1 | T-TYPE CALCIUM CHANNEL MODULATORS AND METHODS OF USE THEREOF | CACNA1G, CACNA1H, CACNA1I | KCNH2 89/4885CACNA1I 3/4885CACNA1G 1/4885 |
“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.