Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | ABCC9 | O60706 | 2/20 | 0.38 |
| ▸ | ABCC8 | Q09428 | 2/20 | 0.38 |
| ▸ | KCNJ11 | Q14654 | 2/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.38 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.38 |
| ▸ | KCNJ8 | Q15842 | 2/20 | 0.38 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 3/20 | 0.37 |
| ▸ | ELANE | P08246 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4649015 | 0.80 | AKR1C1 (0.48) | TSHRALDH1A1CES1KDM4EAKR1C1 | |
| SCHEMBL7149428 | 0.78 | CES1 (0.41) | TDP1TSHRALDH1A1HSD17B10ABCC9 | |
| SCHEMBL28126711 | 0.76 | AKR1C1 (0.58) | ALDH1A1KDM4EL3MBTL1AKR1C1LMNA | |
| SCHEMBL28704810 | 0.74 | TDP1 (0.40) | AAK1TDP1TSHRALDH1A1HSD17B10 | |
| SCHEMBL27572281 | 0.73 | CA12 (0.39) | TDP1TSHRALDH1A1HSD17B10AKR1C1 | |
| SCHEMBL11128335 | 0.72 | TDP1 (0.53) | AAK1TDP1TSHRALDH1A1HSD17B10 | |
| SCHEMBL8752596 | 0.71 | CES2 (0.52) | TDP1TSHRALDH1A1HSD17B10CES1 | |
| SCHEMBL10442833 | 0.70 | TDP1 (0.55) | AAK1TDP1TSHRALDH1A1HSD17B10 | |
| SCHEMBL10770600 | 0.70 | CES2 (0.50) | AAK1TDP1TSHRALDH1A1HSD17B10 | |
| SCHEMBL28352417 | 0.70 | CES1 (0.41) | TDP1TSHRALDH1A1HSD17B10CES1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1937640-A2 | 1,2,3,5-TETRAHYDRO-CYCLOPENTAL[C]QUINOLIN-4-ONE DERIVATIVES AS RXR AGONISTS FOR THE TREATMENT OF DYSLIPIDEMIA, HYPERCHOLESTEROLEMIA AND DIABETES | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-07-02 | — | — | EP | disclosed |
| WO-2007041076-A2 | 1,2,3,5-TETRAHYDRO-CYCLOPENTAL[C]QUINOLIN-4-ONE DERIVATIVES AS RXR AGONISTS FOR THE TREATMENT OF DYSLIPIDEMIA, HYPERCHOLESTEROLEMIA AND DIABETES | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-04-12 | — | — | WO | disclosed |