SCHEMBL4603491

SCHEMBL4603491

Cc1nc(Nc2ccccc2OC2CCOC2)c2c(C)csc2n1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 5/20 0.36
MKNK1 Q9BUB5 5/20 0.36
MKNK2 Q9HBH9 5/20 0.36
JAK2 O60674 2/20 0.35
JAK1 P23458 2/20 0.35
TYK2 P29597 2/20 0.35
JAK3 P52333 2/20 0.35
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
GRM5 P41594 2/20 0.34
EIF4E P06730 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.33
SRC P12931 1/20 0.33
KAT2B Q92831 1/20 0.33
BAZ2B Q9UIF8 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
SCHEMBL3797145 0.86 MKNK1 (0.44) MKNK1MKNK2MAPTEIF4EIRAK4
SCHEMBL3795962 0.86 MKNK1 (0.44) MKNK1MKNK2MAPTEIF4EIRAK4
SCHEMBL3795968 0.86 MKNK1 (0.44) MKNK1MKNK2MAPTEIF4EIRAK4
SCHEMBL3798481 0.80 MKNK2 (0.47) MKNK1MKNK2MAPTIRAK4SRC
SCHEMBL3795880 0.76 MKNK2 (0.49) MKNK1MKNK2EIF4ESRC
SCHEMBL4602472 0.76 TP53 (0.47) ALDH1A1GAAMAPTHPGD
SCHEMBL3804308 0.76 MKNK2 (0.56) MKNK1MKNK2EIF4E
SCHEMBL3804173 0.74 MKNK2 (0.42) MKNK1MKNK2MAPTEIF4ESRC
SCHEMBL3793904 0.72 MAPK1 (0.50) MKNK1MKNK2ALDH1A1GAAMAPT
SCHEMBL3793898 0.72 MAPK1 (0.50) MKNK1MKNK2ALDH1A1GAAMAPT

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-1899353-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DeveloGen Aktiengesellschaft (DE) 2008-03-19 EP disclosed
WO-2006136402-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2006-12-28 WO disclosed