SCHEMBL1026264

SCHEMBL1026264

CC(C)(C)NS(=O)(=O)c1cc(N)cc(CCc2cccc(N(C(=O)O)C(C)(C)C)c2)c1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NSD2 O96028 2/20 0.34
PRMT1 Q99873 1/20 0.34
USP30 Q70CQ3 7/20 0.34
TP53 P04637 1/20 0.34
CYP19A1 P11511 1/20 0.34
ALDH1A1 P00352 3/20 0.34
NPSR1 Q6W5P4 1/20 0.34
PIK3CD O00329 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33

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
SCHEMBL1076529 0.82 IDH1 (0.42) LMNAKDM4EMEN1NPC1MAPT
SCHEMBL1026191 0.81 MAOA (0.50) MEN1KMT2ACYP19A1ALDH1A1
SCHEMBL1024314 0.80 JAK1 (0.43)
SCHEMBL13669912 0.79 KIF18A (0.38) LMNAKDM4EMEN1NPC1MAPT
SCHEMBL13622732 0.77 KAT6A (0.41)
SCHEMBL1026817 0.72 CYP4F2 (0.44) LMNAMEN1NPC1RAB9AKMT2A
SCHEMBL1027535 0.72 MAOA (0.39) LMNAKDM4EMEN1MAPTHPGD
SCHEMBL1026509 0.71 CYP1A2 (0.36) LMNAMEN1NPC1MAPTRAB9A
SCHEMBL1026880 0.71 THRA (0.39) KMT2AALDH1A1NPSR1
SCHEMBL666092 0.71 LOXL2 (0.43) LMNAMEN1NPC1RAB9AKMT2A

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-2274288-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS Incyte Corporation (US) 2011-01-19 EP disclosed