SCHEMBL5044054

SCHEMBL5044054

CCCCCCCCCCCCNC(=O)c1ccc(CC([NH])c2ccccc2C(F)(F)F)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.53
NAAA Q02083 2/20 0.52
EPHX2 P34913 8/20 0.48
PPARG P37231 7/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HDAC6 Q9UBN7 2/20 0.46
HDAC3 O15379 3/20 0.45
PLK1 P53350 1/20 0.45
PLK3 Q9H4B4 1/20 0.45
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CA2 P00918 1/20 0.44

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
SCHEMBL5046108 0.82 PPARG (0.48) MLYCDNAAAEPHX2PPARGL3MBTL1
SCHEMBL5048860 0.79 MLYCD (0.53) MLYCDNAAAEPHX2PPARGL3MBTL1
SCHEMBL5044057 0.77 EPHX2 (0.55) MLYCDNAAAEPHX2PPARGL3MBTL1
SCHEMBL5049002 0.76 LTA4H (0.43)
SCHEMBL28929298 0.74 MLYCD (0.76) MLYCDNAAAEPHX2L3MBTL1HDAC3
SCHEMBL5044168 0.74 ALDH1A1 (0.47) MLYCDNAAAEPHX2PPARGL3MBTL1
SCHEMBL5045562 0.74 ALDH1A1 (0.47) MLYCDNAAAEPHX2PPARGL3MBTL1
SCHEMBL5044173 0.74 MLYCD (0.54) MLYCDNAAAEPHX2L3MBTL1HDAC6
SCHEMBL6716858 0.74 MLYCD (0.54) MLYCDNAAAPPARGL3MBTL1PLK1
SCHEMBL11338002 0.74 MLYCD (0.63) MLYCDNAAAEPHX2L3MBTL1MEN1

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
EP-1732534-B1 USE OF METHYLENE AMIDE DERIVATIVES IN CARDIOVASCULAR DISORDERS SERONO LAB (CH) 2008-07-23 EP claimed