SCHEMBL5149654

SCHEMBL5149654

CC(C)NC(=O)Nc1ccc(Oc2ccc(NC(=O)O)cc2Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PNLIP P16233 9/20 0.52
GCGR P47871 1/20 0.50
PARG Q86W56 1/20 0.49
MAPT P10636 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
MEN1 O00255 1/20 0.47
GAA P10253 1/20 0.47
PKM P14618 1/20 0.47
KMT2A Q03164 1/20 0.47
NPY5R Q15761 1/20 0.47
XIAP P98170 1/20 0.47
RAF1 P04049 1/20 0.47
STK39 Q9UEW8 1/20 0.46
MAPK1 P28482 1/20 0.46
RORC P51449 1/20 0.46

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
SCHEMBL5181890 0.88 PNLIP (0.55) PNLIPGCGRPARGMAPTNPSR1
SCHEMBL5151677 0.86 NPY5R (0.48) MAPTNPSR1MEN1KMT2ANPY5R
SCHEMBL5150280 0.85 PNLIP (0.46) PNLIPMAPTMEN1KMT2ANPY5R
SCHEMBL4687744 0.84 MAPK1 (0.61) MAPTNPSR1MEN1PKMKMT2A
SCHEMBL5151769 0.82 PLA2G7 (0.49) MAPTNPSR1MEN1PKMKMT2A
SCHEMBL11207338 0.82 PNLIP (0.61) PNLIPPARGMAPTNPSR1STK39
SCHEMBL5169607 0.81 TBXA2R (0.50) NPY5RMAPK1
SCHEMBL5148241 0.80 KCNJ6 (0.54) MEN1KMT2AMAPK1
SCHEMBL11008397 0.79 PNLIP (0.69) PNLIPGCGRMAPTNPSR1MEN1
SCHEMBL5152061 0.79 THRA (0.49) MAPTMEN1KMT2ANPY5RMAPK1

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-2007071840-A2 COMPOUNDS BASED ON FOUR AROMATIC RINGS, PREPARATION AND USES THEREOF CEREP (FR) 2007-06-28 WO disclosed