Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLS | O94925 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL963496 | 0.87 | HTT (0.47) | GLSCYP2C9HPGDCYP1A2RAB9A | |
| SCHEMBL965896 | 0.82 | ALDH1A1 (0.51) | GLSHPGDRAB9ASMN1; SMN2NPC1 | |
| SCHEMBL965897 | 0.82 | ALDH1A1 (0.51) | GLSHPGDRAB9ASMN1; SMN2NPC1 | |
| SCHEMBL4554904 | 0.80 | RAB9A (0.34) | CYP2C9HPGDCYP1A2RAB9ASMN1; SMN2 | |
| SCHEMBL964447 | 0.78 | NPC1 (0.40) | CYP2C9HPGDCYP1A2RAB9ASMN1; SMN2 | |
| SCHEMBL4553928 | 0.76 | CA12 (0.35) | CYP2C9HPGDCYP1A2RAB9ASMN1; SMN2 | |
| SCHEMBL963891 | 0.75 | CYP1A2 (0.45) | CYP2C9HPGDCYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL4554658 | 0.74 | CYP1A2 (0.31) | CYP2C9HPGDCYP1A2RAB9ASMN1; SMN2 | |
| SCHEMBL964450 | 0.74 | NPC1 (0.36) | GLSRAB9ASMN1; SMN2NPC1ALDH1A1 | |
| SCHEMBL964449 | 0.74 | NPC1 (0.36) | GLSRAB9ASMN1; SMN2NPC1ALDH1A1 |
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-2118066-A1 | FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA | Takeda Pharmaceutical Company Limited (JP) | 2009-11-18 | — | — | EP | disclosed |
| WO-2008099794-A1 | FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-08-21 | — | — | WO | disclosed |