SCHEMBL6825438

SCHEMBL6825438

COc1cc(Cl)c(C)cc1NC(=O)NC[C@@H](C)CC(=O)N(CCC(C)C)CC(=O)NO

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.41
ALDH1A1 P00352 5/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
MAPK1 P28482 1/20 0.40
MAPT P10636 4/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
GAA P10253 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HTT P42858 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
POLB P06746 1/20 0.38
RAF1 P04049 2/20 0.38
HPGD P15428 1/20 0.38
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL6825884 0.88 ALDH1A1 (0.39) LMNAALDH1A1SMN1; SMN2MAPK1MAPT
SCHEMBL6824961 0.88 ALDH1A1 (0.39) LMNAALDH1A1SMN1; SMN2MAPK1MAPT
SCHEMBL6826030 0.87 ALDH1A1 (0.48) LMNAALDH1A1SMN1; SMN2MAPTL3MBTL1
SCHEMBL6824838 0.86 ALDH1A1 (0.40) LMNAALDH1A1SMN1; SMN2MAPK1MAPT
SCHEMBL6827687 0.86 LMNA (0.40) LMNAALDH1A1SMN1; SMN2MAPK1MAPT
SCHEMBL6825191 0.86 ALDH1A1 (0.40) LMNAALDH1A1SMN1; SMN2MAPK1MAPT
SCHEMBL6825420 0.85 LMNA (0.40) LMNAALDH1A1SMN1; SMN2MAPK1MAPT
SCHEMBL6825239 0.83 ANPEP (0.47) MAPTGAAMEN1KMT2A
SCHEMBL6825590 0.81 TRPV1 (0.44) LMNAL3MBTL1GAAMEN1KMT2A
SCHEMBL6825195 0.81 RAB9A (0.40) LMNAALDH1A1SMN1; SMN2MAPTL3MBTL1

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