SCHEMBL6566283

SCHEMBL6566283

CCC(c1cc(OC)c(OC)cc1C(O)c1ccc(OC)c(OC)c1)C(C)(O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.46
PPARD Q03181 1/20 0.46
PPARA Q07869 1/20 0.46
ACHE P22303 2/20 0.41
LMNA P02545 3/20 0.39
GAA P10253 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 3/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HIF1A Q16665 2/20 0.38
EPAS1 Q99814 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
ALOX12 P18054 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL6567190 0.75 LMNA (0.47) PPARGPPARDPPARAACHELMNA
SCHEMBL6569183 0.75 GAA (0.40) GAACYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL6656697 0.75 PPARG (0.61) PPARGPPARDPPARAACHELMNA
SCHEMBL12776310 0.74 PPARG (0.53) PPARGPPARDPPARAACHELMNA
Ethylene SCHEMBL6569127 0.73 LMNA (0.45) PPARGPPARDPPARAACHELMNA
SCHEMBL4818551 0.72 PPARG (0.51) PPARGPPARDPPARAACHELMNA
SCHEMBL6055371 0.70 PPARG (0.61) PPARGPPARDPPARAACHELMNA
SCHEMBL22420256 0.70 ADRA2A (0.57) PPARGPPARDPPARAACHELMNA
SCHEMBL20676011 0.69 PPARG (0.59) PPARGPPARDPPARAACHELMNA
SCHEMBL15119937 0.68 PPARG (0.54) PPARGPPARDPPARAACHELMNA

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1465879-A2 PROCESS FOR THE PREPARATION OF TOFISOPAM AND NEW INTERMEDIATES EGIS GYOGYSZERGYAR RT. (HU) 2004-10-13 EP claimed
WO-2003050092-A2 PROCESS FOR THE PREPARATION OF TOFISOPAM AND NEW INTERMEDIATES EGIS Gyógyszergyár Rt. (HU) 2003-06-19 WO claimed
EP-1465879-A2 PROCESS FOR THE PREPARATION OF TOFISOPAM AND NEW INTERMEDIATES EGIS GYOGYSZERGYAR RT. (HU) 2004-10-13 EP disclosed
WO-2003050092-A2 PROCESS FOR THE PREPARATION OF TOFISOPAM AND NEW INTERMEDIATES EGIS Gyógyszergyár Rt. (HU) 2003-06-19 WO disclosed