Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4928165 | 0.80 | CES1 (0.38) | — | |
| SCHEMBL11128512 | 0.78 | TDP1 (0.37) | — | |
| SCHEMBL19704836 | 0.78 | — | — | |
| SCHEMBL8613890 | 0.77 | TSHR (0.36) | TSHR | |
| SCHEMBL8534653 | 0.77 | NAALAD2 (0.43) | TSHR | |
| SCHEMBL12570564 | 0.74 | RNPEP (0.39) | — | |
| SCHEMBL19233793 | 0.72 | SMN1; SMN2 (0.35) | TSHR | |
| SCHEMBL825523 | 0.72 | — | — | |
| SCHEMBL15092131 | 0.70 | TSHR (0.37) | TSHR | |
| SCHEMBL24723772 | 0.70 | ALDH1A1 (0.39) | TSHR |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0367598-B1 | NOVEL PROCESS FOR THE PRODUCTION OF 4,6-DIMETHYL-7-HYDROXYNONAN-3-ONE | Philip Morris Products Inc. (US) | 1993-09-01 | — | — | EP | claimed |
| US-4925985-A | GRIGNARD REACTION, REDUCTION, CATALYSIS | PHILIP MORRIS INCORPORATED (US) | 1990-05-15 | — | — | US | claimed |
| EP-0367598-A2 | Novel process for the production of 4,6-dimethyl-7-hydroxynonan-3-one | Philip Morris Products Inc. (US) | 1990-05-09 | — | — | EP | claimed |
| JP-58021631-A | — | — | None | — | — | JP | disclosed |
| JP-3161455-A | — | — | None | — | — | JP | disclosed |
| EP-0367598-B1 | NOVEL PROCESS FOR THE PRODUCTION OF 4,6-DIMETHYL-7-HYDROXYNONAN-3-ONE | Philip Morris Products Inc. (US) | 1993-09-01 | — | — | EP | disclosed |
| EP-0437290-A1 | Process for the preparation of 5-oxohexane nitriles and the compound 2,4-dimethyl-5-oxohexane nitrile | DSM N.V. (NL) | 1991-07-17 | — | — | EP | disclosed |
| JP-H03161455-A | NEW PROCESS FOR PRODUCTION OF 4,6-DIMETHYL-7-HYDROXYNONAN-3-ONE | PHILIP MORRIS PROD INC | 1991-07-11 | — | — | JP | disclosed |
| US-4925985-A | GRIGNARD REACTION, REDUCTION, CATALYSIS | PHILIP MORRIS INCORPORATED (US) | 1990-05-15 | — | — | US | disclosed |
| EP-0367598-A2 | Novel process for the production of 4,6-dimethyl-7-hydroxynonan-3-one | Philip Morris Products Inc. (US) | 1990-05-09 | — | — | EP | disclosed |
| JP-S5821631-A | 4,6-DIMETHYL-NONANE DERIVATIVE AND SEX ATTARACTANT CONSISTING OF IT | JAPAN TOBACCO INC | 1983-02-08 | — | — | JP | disclosed |