SCHEMBL6963261

SCHEMBL6963261

CN(Cc1ccc2cc(CC3SC(=O)NC3=O)cnc2c1)c1ccccn1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 0.59
RXRA P19793 2/20 0.54
RARG P13631 1/20 0.54
AKT1 P31749 1/20 0.39
PIK3CA P42336 1/20 0.39
PPARA Q07869 2/20 0.39
ALDH1A1 P00352 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
FFAR1 O14842 3/20 0.39
CYP3A4 P08684 1/20 0.39
HIF1A Q16665 1/20 0.39
EPAS1 Q99814 1/20 0.39
MPC2 O95563 1/20 0.38
CYP2C8 P10632 1/20 0.38
CYP2C9 P11712 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
SCHEMBL6964865 0.89 PPARG (0.49) PPARGRXRARARGPPARAALDH1A1
SCHEMBL6965562 0.86 PPARG (0.74) PPARGRXRARARGPPARAALDH1A1
SCHEMBL6184136 0.81 PPARG (0.64) PPARGRXRARARGPPARAFFAR1
SCHEMBL6965557 0.81 PPARG (0.54) PPARGRXRARARGPPARAFFAR1
SCHEMBL6963704 0.79 PPARG (0.49) PPARGRXRAAKT1PIK3CAPPARA
SCHEMBL23578851 0.77 PPARG (0.50) PPARGRXRAAKT1PIK3CAPPARA
SCHEMBL29764689 0.77 PPARG (0.50) PPARGRXRAAKT1PIK3CAPPARA
SCHEMBL15348621 0.77 PPARG (0.79) PPARGRXRARARGPPARAFFAR1
SCHEMBL6964875 0.77 FFAR1 (0.61) PPARGRXRAPPARAFFAR1CYP3A4
SCHEMBL6955783 0.76 FFAR1 (0.48) PPARGRXRAPPARAFFAR1CYP3A4

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0787725-B1 QUINOLINE DERIVATIVE NIPPON CHEMIPHAR CO (JP) 2003-04-23 EP disclosed
EP-0787725-A1 QUINOLINE DERIVATIVE NIPPON CHEMIPHAR CO., LTD. (JP) 1997-08-06 EP disclosed