Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXA2R | P21731 | 2/20 | 0.44 |
| ▸ | HMGCR | P04035 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | CPT2 | P23786 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TBXAS1 | P24557 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 3/20 | 0.31 |
| ▸ | NSD2 | O96028 | 1/20 | 0.31 |
| ▸ | GRK2 | P25098 | 1/20 | 0.31 |
| ▸ | CASP6 | P55212 | 1/20 | 0.31 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23182611 | 0.81 | SMN1; SMN2 (0.40) | CYP2C19HIF1AALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL17233622 | 0.74 | CYP2C19 (0.35) | TBXA2RHMGCRCHRM1ADRA1ACYP2C19 | |
| SCHEMBL23666128 | 0.71 | HMGCR (0.40) | TBXA2RHMGCRCHRM1ADRA1ACYP2C19 | |
| SCHEMBL14249210 | 0.71 | KDM4E (0.43) | TBXA2RHMGCRCHRM1ADRA1ACYP2C19 | |
| SCHEMBL7417294 | 0.71 | — | — | |
| SCHEMBL2183850 | 0.69 | CYP1A2 (0.30) | — | |
| .Beta.-Hydroxyisovaleric Acid SCHEMBL8434567 | 0.69 | HMGCR (0.60) | TBXA2RHMGCRCHRM1ADRA1ACYP2C19 | |
| SCHEMBL18127402 | 0.68 | HMGCR (0.41) | TBXA2RHMGCRCHRM1ADRA1ACYP2C19 | |
| SCHEMBL24692277 | 0.68 | — | — | |
| SCHEMBL95498 | 0.68 | — | — |
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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11053242-B2 | [9,10-dimethoxy-3-(2-methylpropyl)-1H,2H,3H,4H,6H,7H,11BH-pyrido-[2,1-a]isoquinolin-2-yl]methanol and compounds, compositions and methods relating thereto | NEUROCRINE BIOSCIENCES, INC. (US) | 2021-07-06 | — | — | US | disclosed |
| US-20200262834-A1 | [9,10-DIMETHOXY-3-(2-METHYLPROPYL)-1H,2H,3H,4H,6H,7H,11BH-PYRIDO-[2,1-A]ISOQUINOLIN-2-YL]METHANOL AND COMPOUNDS, COMPOSITIONS AND METHODS RELATING THERETO | NEUROCRINE BIOSCIENCES, INC. | 2020-08-20 | — | — | US | disclosed |
| EP-2102317-B1 | ADDITIVE, FUEL COMPOSITION, METHOD AND USE | INNOSPEC LTD (GB) | 2018-10-17 | — | — | EP | disclosed |
| US-9988382-B2 | [9,10-dimethoxy-3-(2-methylpropyl)-1H,2H,3H,4H,6H,7H,11bH-pyrido-[2,1-A]isoquinolin-2-yl]methanol and compounds, compositions and methods relating thereto | NEUROCRINE BIOSCIENCES, INC. (US) | 2018-06-05 | — | — | US | disclosed |
| US-9988382-B2 | [9,10-dimethoxy-3-(2-methylpropyl)-1H,2H,3H,4H,6H,7H,11bH-pyrido-[2,1-A]isoquinolin-2-yl]methanol and compounds, compositions and methods relating thereto | NEUROCRINE BIOSCIENCES, INC. (US) | 2018-06-05 | — | — | US | disclosed |
| US-20170349586-A1 | [9,10-DIMETHOXY-3-(2-METHYLPROPYL)-1H,2H,3H,4H,6H,7H,11BH-PYRIDO-[2,1-A]ISOQUINOLIN-2-YL]METHANOL AND COMPOUNDS, COMPOSITIONS AND METHODS RELATING THERETO | NEUROCRINE BIOSCIENCES, INC. | 2017-12-07 | — | — | US | disclosed |
| US-20170349586-A1 | [9,10-DIMETHOXY-3-(2-METHYLPROPYL)-1H,2H,3H,4H,6H,7H,11BH-PYRIDO-[2,1-A]ISOQUINOLIN-2-YL]METHANOL AND COMPOUNDS, COMPOSITIONS AND METHODS RELATING THERETO | NEUROCRINE BIOSCIENCES, INC. | 2017-12-07 | — | — | US | disclosed |
| US-9714246-B2 | [9,10-dimethoxy-3-(2-methylpropyl)-1H,2H,3H,4H,6H,7H,11bH-pyrido-[2,1-a]isoquinolin-2-yl]methanol and compounds, compositions and methods relating thereto | NEUROCRINE BIOSCIENCES, INC. (US) | 2017-07-25 | — | — | US | disclosed |
| US-9714246-B2 | [9,10-dimethoxy-3-(2-methylpropyl)-1H,2H,3H,4H,6H,7H,11bH-pyrido-[2,1-a]isoquinolin-2-yl]methanol and compounds, compositions and methods relating thereto | NEUROCRINE BIOSCIENCES, INC. (US) | 2017-07-25 | — | — | US | disclosed |
| US-20160289226-A1 | [9,10-DIMETHOXY-3-(2-METHYLPROPYL)-1H,2H,3H,4H,6H,7H,11BH-PYRIDO-[2,1-A]ISOQUINOLIN-2-YL]METHANOL AND COMPOUNDS, COMPOSITIONS AND METHODS RELATING THERETO | NEUROCRINE BIOSCIENCES, INC. | 2016-10-06 | — | — | US | disclosed |
| WO-2006091592-A1 | NAPHTHALENE DERIVATIVES AS MODULATORS OF THE GLUCOCORTICOID RECEPTOR | SMITHKLINE BEECHAM CORPORATION (US) | 2006-08-31 | — | — | WO | disclosed |
| EP-1230327-B1 | FUEL ADDITIVE FOR THE PREVENTION OF VALVE SEAT RECESSION | ASS OCTEL (GB) | 2006-06-07 | — | — | EP | disclosed |
| WO-2005087901-A2 | FUEL ADDITIVE COMPOSITION HAVING ANTIKNOCK PROPERTIES | INNOSPEC LIMITED (GB) | 2005-09-22 | — | — | WO | disclosed |
| WO-2004055136-A1 | USE OF METAL TO PREVENT SPARK PLUGS FOULING FROM IRON | THE ASSOCIATED OCTEL COMPANY LIMITED (GB) | 2004-07-01 | — | — | WO | disclosed |
| EP-1047755-B1 | FUEL ADDITIVES | ASS OCTEL (GB) | 2003-04-23 | — | — | EP | disclosed |
| US-6488725-B1 | REGENERATING FILTER TRAP BY ADDING SYNERGISTIC MIXTURE OF IRON COMPOUND AND BARIUM AND/OR STRONTIUM COMPOUND BEFORE OR DURING COMBUSTION; DIESEL ENGINES | THE ASSOCIATED OCTEL COMPANY LIMITED (GB) | 2002-12-03 | — | — | US | disclosed |
| EP-1230327-A1 | FUEL ADDITIVE FOR THE PREVENTION OF VALVE SEAT RECESSION | The Associated Octel Company Limited (GB) | 2002-08-14 | — | — | EP | disclosed |
| WO-2001016257-A1 | FUEL ADDITIVE FOR THE PREVENTION OF VALVE SEAT RECESSION | THE ASSOCIATED OCTEL COMPANY LIMITED (GB) | 2001-03-08 | — | — | WO | disclosed |
| EP-1047755-A1 | FUEL ADDITIVES | THE ASSOCIATED OCTEL COMPANY LIMITED (GB) | 2000-11-02 | — | — | EP | disclosed |
| WO-1999036488-A1 | FUEL ADDITIVES | THE ASSOCIATED OCTEL COMPANY LIMITED (GB) | 1999-07-22 | — | — | 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 (4 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-20160289226-A1 | [9,10-DIMETHOXY-3-(2-METHYLPROPYL)-1H,2H,3H,4H,6H,7H,11BH-PYRIDO-[2,1-A]ISOQUINOLIN-2-YL]METHANOL AND COMPOUNDS, COMPOSITIONS AND METHODS RELATING THERETO | SLC18A2, SLC6A2, SLC18A1 | TBXA2R 1405/4885HMGCR 1433/4885CHRM1 327/4885 |
| US-20170349586-A1 | [9,10-DIMETHOXY-3-(2-METHYLPROPYL)-1H,2H,3H,4H,6H,7H,11BH-PYRIDO-[2,1-A]ISOQUINOLIN-2-YL]METHANOL AND COMPOUNDS, COMPOSITIONS AND METHODS RELATING THERETO | SLC18A2, SLC6A2, SLC18A1 | TBXA2R 1405/4885HMGCR 1433/4885CHRM1 327/4885 |
| US-11053242-B2 | [9,10-dimethoxy-3-(2-methylpropyl)-1H,2H,3H,4H,6H,7H,11BH-pyrido-[2,1-a]isoquinolin-2-yl]methanol and compounds, compositions and methods relating thereto | SLC18A2, SLC6A2, SLC18A1 | TBXA2R 1405/4885HMGCR 1433/4885CHRM1 327/4885 |
| US-20200262834-A1 | [9,10-DIMETHOXY-3-(2-METHYLPROPYL)-1H,2H,3H,4H,6H,7H,11BH-PYRIDO-[2,1-A]ISOQUINOLIN-2-YL]METHANOL AND COMPOUNDS, COMPOSITIONS AND METHODS RELATING THERETO | SLC18A2, SLC6A2, SLC18A1 | TBXA2R 1405/4885HMGCR 1433/4885CHRM1 327/4885 |
“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.