SCHEMBL6435667

SCHEMBL6435667

CC(C)(C)OC(=O)N(N)c1nc2nonc2nc1Nc1ccc(Cl)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
TP53 P04637 5/20 0.42
CCR2 P41597 1/20 0.42
CCR5 P51681 1/20 0.42
GAA P10253 1/20 0.41
RECQL P46063 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HTT P42858 2/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.39
KDR P35968 4/20 0.36
EPHA2 P29317 4/20 0.36
EPHB4 P54760 4/20 0.36
MAPK14 Q16539 1/20 0.35
CDKN1A P38936 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
DHODH Q02127 1/20 0.34
SYK P43405 1/20 0.34

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
SCHEMBL6436802 0.87 MAPT (0.44) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL6431994 0.85 GAA (0.46) MAPTSMN1; SMN2TP53GAARECQL
SCHEMBL6439454 0.84 GAA (0.45) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL6416982 0.78 MAPT (0.45) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL3054070 0.78 MAPT (0.39) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL3060981 0.78 MAPT (0.44) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL6432336 0.76 SMN1; SMN2 (0.37) MAPTSMN1; SMN2TP53GAARECQL
SCHEMBL3054066 0.74 MAPT (0.43) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL3051396 0.73 TP53 (0.55) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL3052187 0.72 HTT (0.57) MAPTSMN1; SMN2TP53CCR2CCR5

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
WO-2005044270-A1 OXADIAZOLOPYRAZINE DERIVATIVES AS PHARMACEUTICALLY ACTIVE COMPOUNDS 4SC AG (DE) 2005-05-19 WO disclosed