Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.42 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 3/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.40 |
| ▸ | ACP3 | P15309 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.38 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.38 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.38 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.38 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.38 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16960887 | 0.83 | ACHE (0.46) | ACHEAOC3CYP19A1ACP3PSEN1 | |
| SCHEMBL6374643 | 0.80 | TAS1R3 (0.42) | TAS1R3TAS1R1ACHEAOC3CYP19A1 | |
| SCHEMBL135231 | 0.79 | AOC3 (0.46) | AOC3LMNA | |
| SCHEMBL23183027 | 0.78 | TAS1R3 (0.41) | TAS1R3TAS1R1ACHEAOC3CYP19A1 | |
| SCHEMBL16950584 | 0.78 | AOC3 (0.41) | ACHEAOC3CYP19A1SLC6A2SLC6A4 | |
| SCHEMBL18242949 | 0.78 | TAS1R3 (0.45) | TAS1R3TAS1R1ACHEAOC3CYP19A1 | |
| SCHEMBL16956482 | 0.78 | OPRM1 (0.44) | AOC3ACP3SLC6A4 | |
| SCHEMBL14402512 | 0.78 | TAS1R3 (0.45) | TAS1R3TAS1R1ACHEAOC3ACP3 | |
| SCHEMBL13849155 | 0.78 | TAS1R3 (0.45) | TAS1R3TAS1R1ACHEAOC3ACP3 | |
| SCHEMBL6546957 | 0.78 | CYP19A1 (0.51) | TAS1R3TAS1R1ACHEAOC3CYP19A1 |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7348454-B2 | Process for the hydrocarboxylation of ethylenically unsaturated carboxylic acids | SHELL OIL COMPANY (US) | 2008-03-25 | — | — | US | disclosed |
| US-7265242-B2 | Process for the carbonylation of ethylenically or acetylenically unsaturated compounds | SHELL OIL COMPANY (US) | 2007-09-04 | — | — | US | disclosed |
| EP-1735263-A1 | PROCESS FOR THE CARBONYLATION OF ETHYLENICALLY OR ACETYLENICALLY UNSATURATED COMPOUNDS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 2006-12-27 | — | — | EP | disclosed |
| EP-1730096-A1 | PROCESS FOR THE CARBONYLATION OF A CONJUGATED DIENE | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 2006-12-13 | — | — | EP | disclosed |
| US-20060235241-A1 | Process for the carbonylation of a conuugated diene | SHELL OIL COMPANY | 2006-10-19 | — | — | US | disclosed |
| US-20060224015-A1 | Process for the hydrocarboxylation of ethylenically unsaturated carboxylic acids | SHELL OIL COMPANY | 2006-10-05 | — | — | US | disclosed |
| EP-1628946-A1 | PROCESS FOR THE HYDROCARBOXYLATION OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACIDS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 2006-03-01 | — | — | EP | disclosed |
| EP-1625109-A1 | PROCESS FOR THE CARBONYLATION OF A CONJUGATED DIENE | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 2006-02-15 | — | — | EP | disclosed |
| WO-2005082830-A1 | PROCESS FOR THE CARBONYLATION OF ETHYLENICALLY OR ACETYLENICALLY UNSATURATED COMPOUNDS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2005-09-09 | — | — | WO | disclosed |
| WO-2005082829-A1 | PROCESS FOR THE CARBONYLATION OF A CONJUGATED DIENE | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2005-09-09 | — | — | WO | disclosed |
| US-20050192457-A1 | Process for the carbonylation of ethylenically or acetylenically unsaturated compounds | SHELL OIL COMPANY | 2005-09-01 | — | — | US | disclosed |
| WO-2004103948-A1 | PROCESS FOR THE CARBONYLATION OF A CONJUGATED DIENE | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2004-12-02 | — | — | WO | disclosed |
| WO-2004103942-A1 | PROCESS FOR THE HYDROCARBOXYLATION OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACIDS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2004-12-02 | — | — | WO | disclosed |
| EP-1263709-B1 | PROCESS FOR THE CARBONYLATION OF ETHYLENICALLY UNSATURATED COMPOUNDS | SHELL INT RESEARCH (NL) | 2004-05-12 | — | — | EP | disclosed |
| US-6706912-B2 | CARBON MONOXIDE REACTED WITH ALCOHOL IN PRESENCE OF CATALYST SYSTEM COMPRISING PALLADIUM CATIONS, BIDENTATE DIPHOSPHINE, AND ANIONS DERIVED FROM SULFONIC ACID, IN APRIOTIC SOLVENT (ANISOLE) | SHELL OIL COMPANY | 2004-03-16 | — | — | US | disclosed |
| EP-1263709-A2 | PROCESS FOR THE CARBONYLATION OF ETHYLENICALLY UNSATURATED COMPOUNDS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 2002-12-11 | — | — | EP | disclosed |
| US-20010044556-A1 | Process for the carbonylation of ethylenically unsaturated compounds | SHELL OIL COMPANY | 2001-11-22 | — | — | US | disclosed |
| WO-2001068583-A2 | PROCESS FOR THE CARBONYLATION OF ETHYLENICALLY UNSATURATED COMPOUNDS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2001-09-20 | — | — | 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 (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-20050192457-A1 | Process for the carbonylation of ethylenically or acetylenically unsaturated compounds | C5, C9, CBR1 | TAS1R3 3338/4885TAS1R1 2816/4885ACHE 3235/4885 |
“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.