Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EP300 | Q09472 | 1/20 | 0.39 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | F7 | P08709 | 1/20 | 0.34 |
| ▸ | F3 | P13726 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | GMNN | O75496 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7939276 | 1.00 | EP300 (0.39) | EP300GRIK1TSHRF7F3 | |
| SCHEMBL9799758 | 0.79 | EP300 (0.36) | EP300GRIK1TSHRF7F3 | |
| SCHEMBL9799762 | 0.79 | EP300 (0.36) | EP300GRIK1TSHRF7F3 | |
| SCHEMBL1785114 | 0.78 | EP300 (0.45) | EP300GRIK1TSHRF7F3 | |
| SCHEMBL309931 | 0.78 | EP300 (0.45) | EP300GRIK1TSHRF7F3 | |
| SCHEMBL18349201 | 0.78 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL27885956 | 0.76 | EP300 (0.34) | EP300GRIK1TSHRF7F3 | |
| SCHEMBL6910247 | 0.76 | EP300 (0.54) | EP300GRIK1TSHRF7F3 | |
| SCHEMBL2406221 | 0.76 | EP300 (0.54) | EP300GRIK1TSHRF7F3 | |
| SCHEMBL22546 | 0.76 | EP300 (0.54) | EP300GRIK1TSHRF7F3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0768294-B1 | Process for preparing 2,4,4,7-tetramethyl-oct-6-en-3-on and its use as perfume | HAARMANN & REIMER GMBH (DE) | 2001-09-12 | — | — | EP | disclosed |
| US-6252120-B1 | ALKENYLATION OF DIISOPROPYL KETONE WITH 1-CHLORO-3-METHYL-2-BUTENE IN AN AQUEOUS PHASE CATALYZED BY A PHASE TRANSFER CATALYST | HAARMANN & REIMER GMBH (DE) | 2001-06-26 | — | — | US | disclosed |
| EP-0768294-A1 | Process for preparing 2,4,4,7-tetramethyl-oct-6-en-3-on and its use as perfume | HAARMANN & REIMER GMBH (DE) | 1997-04-16 | — | — | EP | disclosed |