Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 5/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.42 |
| ▸ | FAAH | O00519 | 3/20 | 0.41 |
| ▸ | CES1 | P23141 | 3/20 | 0.41 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | NCOR1 | O75376 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4644398 | 0.82 | KCNN4 (0.38) | HDAC1HDAC2CES1KCNN4CYP1A2 | |
| SCHEMBL11595736 | 0.81 | L3MBTL1 (0.42) | HDAC1HDAC2FAAHCES1KCNN4 | |
| SCHEMBL34229 | 0.80 | HDAC1 (0.51) | HDAC1HDAC2FAAHCES1HDAC3 | |
| SCHEMBL8939158 | 0.80 | KCNN4 (0.48) | CES1KCNN4CYP1A2MAPT | |
| SCHEMBL4644154 | 0.76 | KCNN4 (0.39) | HDAC1HDAC2CES1KCNN4CYP1A2 | |
| SCHEMBL4641546 | 0.74 | CYP1A2 (0.48) | HDAC1HDAC2CES1CYP1A2HDAC3 | |
| SCHEMBL4642060 | 0.72 | KCNN4 (0.41) | CES1KCNN4CYP1A2LMNAMAPT | |
| SCHEMBL27724307 | 0.71 | CYP2C19 (0.42) | HDAC1HDAC2CYP1A2LMNAMAPT | |
| SCHEMBL2238406 | 0.71 | TDP1 (0.76) | HDAC1HDAC2CES1CYP1A2HDAC3 | |
| SCHEMBL8939183 | 0.70 | ALDH1A1 (0.49) | KCNN4CYP1A2 |
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-4075407-A | HETEROCYCLIC PHOSPHONIUM SALTS | G. D. SEARLE & CO. (US) | 1978-02-21 | — | — | US | disclosed |
| US-4056562-A | 3,5-Bisoxygenated 2-(ω-halo-3-oxygenated-1-alkenyl)-cyclopentane-1-heptanoic acids and derivatives thereof | G. D. SEARLE & CO. (US) | 1977-11-01 | — | — | US | disclosed |
| US-4041050-A | 3,5-Bisoxygenated 2-(ω-halo-3-oxo-1-alkenyl)-cyclopentane-1-heptanoic acids and derivatives thereof | G. D. SEARLE & CO. (US) | 1977-08-09 | — | — | US | disclosed |
| US-3997588-A | 3,5-Bisoxygenated 2-(ω-halo-3-oxygenated-1-alkenyl)-cyclopentane-1-heptanoic acids and derivatives thereof | G. D. SEARLE & CO. (US) | 1976-12-14 | — | — | US | disclosed |