SCHEMBL4683386

SCHEMBL4683386

Cc1ccc(C(=O)c2cccn2C/C=C/c2cccc(CC(=O)O)c2)cc1

nearest known ligand 0.80

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.80
PPARA Q07869 7/20 0.80
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
ALOX12 P18054 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 1/20 0.41
CXCL8 P10145 1/20 0.40
AKR1B1 P15121 1/20 0.40
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
GLO1 Q04760 1/20 0.40
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL4683389 1.00 PPARG (0.80) PPARGPPARAALDH1A1MEN1LMNA
SCHEMBL4679556 0.90 PPARG (0.66) PPARGPPARAALDH1A1MEN1LMNA
SCHEMBL14143473 0.90 PPARG (0.68) PPARGPPARAALDH1A1MEN1LMNA
SCHEMBL4679548 0.90 PPARG (0.66) PPARGPPARAALDH1A1MEN1LMNA
SCHEMBL2719814 0.89 PPARG (0.67) PPARGPPARAALDH1A1MEN1LMNA
SCHEMBL2719820 0.89 PPARG (0.67) PPARGPPARAALDH1A1MEN1LMNA
SCHEMBL14143467 0.89 PPARG (0.70) PPARGPPARAALDH1A1MEN1LMNA
SCHEMBL2717139 0.88 PPARG (0.66) PPARGPPARAALDH1A1MEN1LMNA
SCHEMBL2717135 0.88 PPARG (0.66) PPARGPPARAALDH1A1MEN1LMNA
SCHEMBL4680580 0.88 PPARG (0.63) PPARGPPARAALDH1A1MEN1LMNA

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-1386913-B1 PYRROLE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO (JP) 2008-07-16 EP disclosed
EP-1386913-B1 PYRROLE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO (JP) 2008-07-16 EP disclosed
US-7220773-B2 Heterocylic amines used as antidiabetic or hyperglycemic agents DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-05-22 US disclosed
US-7220773-B2 Heterocylic amines used as antidiabetic or hyperglycemic agents DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-05-22 US disclosed