Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 6/20 | 0.36 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | LPAR3 | Q9UBY5 | 3/20 | 0.32 |
| ▸ | GGPS1 | O95749 | 3/20 | 0.32 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.32 |
| ▸ | LPAR2 | Q9HBW0 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.32 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11761617 | 0.87 | CYP3A4 (0.42) | FDPSSMPD1CES2LPAR3GGPS1 | |
| SCHEMBL11761619 | 0.86 | LPAR3 (0.44) | FDPSSMPD1LPAR3GGPS1LPAR1 | |
| SCHEMBL11513063 | 0.85 | FDPS (0.33) | FDPSSMPD1CES2LPAR3GGPS1 | |
| SCHEMBL9806955 | 0.83 | CYP3A4 (0.34) | FDPSSMPD1CES2LPAR3GGPS1 | |
| SCHEMBL9785204 | 0.77 | GGPS1 (0.40) | FDPSSMPD1LPAR3GGPS1LPAR1 | |
| SCHEMBL5320670 | 0.76 | FDPS (0.35) | FDPSCES2CYP4F2CYP4A11 | |
| SCHEMBL27748291 | 0.74 | MAPK1 (0.36) | — | |
| SCHEMBL16841368 | 0.74 | FDPS (0.35) | FDPSSMPD1GGPS1CYP3A4CYP4F2 | |
| SCHEMBL9162912 | 0.73 | CES2 (0.33) | CES2CYP3A4CYP4F2CYP4A11 | |
| SCHEMBL4940540 | 0.72 | PPARD (0.39) | FDPSSMPD1LPAR3GGPS1LPAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4524151-A | 7-Oxabicycloheptane thio ethers useful as cardiovascular agents | E. R. SQUIBB & SONS, INC. (US) | 1985-06-18 | — | — | US | disclosed |
| US-4522949-A | 7-Oxabicycloheptane substituted prostaglandin interphenylene analogs useful as cardiovascular agents | E. R. SQUIBB & SONS, INC. (US) | 1985-06-11 | — | — | US | disclosed |