SCHEMBL4087304

SCHEMBL4087304

N#Cc1ccc(-c2csc(N)n2)cc1.N#Cc1ccc(-c2csc(N3CCOC3=O)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.51
MAPT P10636 5/20 0.50
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
GAA P10253 2/20 0.50
RECQL P46063 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
EGFR P00533 2/20 0.41
ERBB2 P04626 2/20 0.41
KDR P35968 2/20 0.41
ERBB4 Q15303 2/20 0.41
MKNK2 Q9HBH9 2/20 0.41
JAK2 O60674 1/20 0.41
PRKD3 O94806 1/20 0.41
ABL1 P00519 1/20 0.41
LCK P06239 1/20 0.41
CDK1 P06493 1/20 0.41
CSF1R P07333 1/20 0.41
LYN P07948 1/20 0.41
RET P07949 1/20 0.41

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
SCHEMBL4078466 0.95 AR (0.55) ARMAPTKMT2AMEN1GAA
SCHEMBL4083245 0.80 NPC1 (0.60) ARMAPTKMT2AMEN1GAA
SCHEMBL4079438 0.80 RAB9A (0.60) ARMAPTKMT2AMEN1ERBB2
SCHEMBL128355 0.78 GAA (0.67) ARMAPTKMT2AMEN1GAA
SCHEMBL4078179 0.74 GAA (0.54) ARMAPTKMT2AMEN1GAA
SCHEMBL17014750 0.73 AR (0.69) ARMAPTKMT2AMEN1GAA
SCHEMBL3863110 0.73 RAB9A (0.57) ARMAPTKMT2AMEN1ERBB2
SCHEMBL4078988 0.73 GAA (0.55) ARMAPTKMT2AMEN1GAA
SCHEMBL4084526 0.73 AR (0.53) ARMAPTKMT2AMEN1GAA
SCHEMBL23299517 0.72 GRM2 (0.43) KDM4ETP53MAOAMAOB

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
EP-2054410-A2 OXAZOLIDONE DERIVATIVES AS PR MODULATORS Wyeth (US) 2009-05-06 EP disclosed
WO-2008021331-A2 OXAZOLIDONE DERIVATIVES AS PR MODULATORS WYETH (US) 2008-02-21 WO disclosed