SCHEMBL6825283

SCHEMBL6825283

CC(C)(CNC(=O)Nc1cccc(F)c1)CC(=O)N(CC(=O)NO)CC1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
MEN1 O00255 2/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
EPHX2 P34913 2/20 0.39
SLC6A9 P48067 1/20 0.38
EPHX1 P07099 1/20 0.38
CASP3 P42574 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
MTOR P42345 1/20 0.38
GRM5 P41594 1/20 0.37
PKM P14618 1/20 0.36

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
SCHEMBL6822393 0.91 SLC6A9 (0.42) SLC6A9
SCHEMBL6825042 0.90 MEN1 (0.43) KMT2ANPC1RAB9AMEN1SMN1; SMN2
SCHEMBL6827891 0.90 NPC1 (0.44) KMT2ANPC1RAB9AMEN1SMN1; SMN2
SCHEMBL6825458 0.89 KLK7 (0.39) KMT2ANPC1RAB9AMEN1SMN1; SMN2
SCHEMBL6827780 0.89 EPHX2 (0.53) KMT2ANPC1RAB9AMEN1GAA
SCHEMBL6822147 0.89 SMN1; SMN2 (0.41) KMT2ANPC1RAB9AMEN1SMN1; SMN2
SCHEMBL6822406 0.87 KMT2A (0.49) KMT2AGRM5
SCHEMBL6827756 0.86 NPC1 (0.46) KMT2ANPC1RAB9AMEN1GAA
SCHEMBL6822389 0.86 MEN1 (0.38) KMT2ANPC1RAB9AMEN1SMN1; SMN2
SCHEMBL6822302 0.84 KMT2A (0.40) KMT2ANPC1RAB9AMEN1SMN1; SMN2

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
WO-2004087643-A1 DEFORMYLASE INHIBITOR, PROCESS FOR PREPARING THE SAME, AND ANTIBACTERIAL COMPOSITION COMPRISING THE SAME PROMEDITECH INC. (KR) 2004-10-14 WO claimed
WO-2004087643-A1 DEFORMYLASE INHIBITOR, PROCESS FOR PREPARING THE SAME, AND ANTIBACTERIAL COMPOSITION COMPRISING THE SAME PROMEDITECH INC. (KR) 2004-10-14 WO disclosed