Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | FTH1 | P02794 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| 3,7-Epoxycaryophyllan-6-Ol SCHEMBL24176170 | 0.70 | CYP3A4 (1.00) | CYP3A4ALDH1A1FTH1CYP2C9CYP2C19 | |
| 3,7-Epoxycaryophyllan-6-Ol SCHEMBL24176356 | 0.70 | CYP3A4 (1.00) | CYP3A4ALDH1A1FTH1CYP2C9CYP2C19 | |
| SCHEMBL4274557 | 0.69 | CYP3A4 (0.57) | CYP3A4ALDH1A1LMNAMAPTTSHR | |
| SCHEMBL4272327 | 0.66 | CYP3A4 (0.41) | CYP3A4ALDH1A1LMNAMAPTTSHR | |
| SCHEMBL10774216 | 0.64 | CYP3A4 (0.39) | CYP3A4 | |
| SCHEMBL24474355 | 0.64 | LMNA (0.41) | LMNAMAPTTSHRMAPK1RECQL | |
| SCHEMBL19973096 | 0.60 | CYP3A4 (0.42) | CYP3A4ALDH1A1LMNAMAPTFTH1 | |
| Beta-Caryophyllene Alcohol SCHEMBL22108417 | 0.59 | ALDH1A1 (1.00) | CYP3A4ALDH1A1LMNAMAPT | |
| Beta-Caryophyllene Alcohol SCHEMBL17627671 | 0.59 | ALDH1A1 (1.00) | CYP3A4ALDH1A1LMNAMAPT | |
| Beta-Caryophyllene Alcohol SCHEMBL3508459 | 0.59 | ALDH1A1 (1.00) | CYP3A4ALDH1A1LMNAMAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090197949-A1 | ANTITUMOR METHODS AND COMPOSITIONS COMPRISING SESQUITERPENE DERIVATIVES | F.P.L. PHARMA, INC. (CA) | 2009-08-06 | — | — | US | disclosed |
| US-20040191342-A1 | Antitumor methods and compositions comprising sesquiterpene derivatives | F.P.L. PHARMA INC. (CA) | 2004-09-30 | — | — | US | disclosed |
| EP-1372677-A1 | ANTITUMOR METHODS AND COMPOSITIONS COMPRISING SESQUITERPENE DERIVATIVES | F.P.L. Pharma Inc. (CA) | 2004-01-02 | — | — | EP | disclosed |
| WO-2002078719-A1 | ANTITUMOR METHODS AND COMPOSITIONS COMPRISING SESQUITERPENE DERIVATIVES | F.P.L. PHARMA INC. (CA) | 2002-10-10 | — | — | WO | disclosed |