SCHEMBL7565841

SCHEMBL7565841

O=C1NC(=O)C(Cc2ccc(-c3cccc(CCNC(=O)c4cc(Cl)cc(Cl)c4)c3)cc2)S1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.52
MCHR1 Q99705 2/20 0.46
PPARG P37231 5/20 0.44
PPARA Q07869 1/20 0.43
ALDH1A1 P00352 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HIF1A Q16665 1/20 0.42
MAPT P10636 2/20 0.41
MPC2 O95563 1/20 0.41
CYP2C8 P10632 1/20 0.41
CYP2C9 P11712 1/20 0.41
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
ACLY P53396 1/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL6526188 0.89 FFAR1 (0.59) FFAR1MCHR1PPARGPPARAMAPT
SCHEMBL7089664 0.87 FFAR1 (0.52) FFAR1MCHR1PPARGPPARAALDH1A1
SCHEMBL5399583 0.85 FFAR1 (0.61) FFAR1PPARGPPARAALDH1A1NPSR1
SCHEMBL7090957 0.84 FFAR1 (0.49) FFAR1MCHR1PPARGPPARAMAPT
SCHEMBL6185086 0.83 FFAR1 (0.55) FFAR1MCHR1PPARGPPARAMPC2
SCHEMBL6473379 0.82 FFAR1 (0.61) FFAR1PPARGPPARAMAPTMPC2
SCHEMBL6477698 0.81 FFAR1 (0.57) FFAR1PPARGPPARAMAPTMPC2
SCHEMBL6473789 0.81 FFAR1 (0.58) FFAR1PPARGPPARAALDH1A1MAPT
SCHEMBL6473029 0.80 FFAR1 (0.55) FFAR1PPARGPPARAMPC2CYP2C8
SCHEMBL6184625 0.79 FFAR1 (0.61) FFAR1PPARGMAPTMPC2CYP2C8

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002012210-A9 BIPHENYL DERIVATIVES AND THEIR USE AS PPAR-GAMMA RECEPTOR ACTIVATORS GALDERMA RES & DEV (FR) 2002-04-18 WO claimed