SCHEMBL5728256

SCHEMBL5728256

CN(C)CCNC(=O)c1c[nH]c(C=C2CNc3ccc(NC(N)=O)cc32)c1

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AKT2 P31751 18/20 0.71
PDPK1 O15530 6/20 0.59
PDK1 Q15118 2/20 0.59
EGFR P00533 1/20 0.39
CSF1R P07333 1/20 0.39
PDGFRB P09619 1/20 0.39
KIT P10721 1/20 0.39
FGFR1 P11362 1/20 0.39
KDR P35968 1/20 0.39
FLT3 P36888 1/20 0.39

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
SCHEMBL5727947 0.84 AKT2 (0.74) AKT2PDPK1PDK1KDR
SCHEMBL5727779 0.83 AKT2 (1.00) AKT2PDPK1PDK1
SCHEMBL5727776 0.83 AKT2 (1.00) AKT2PDPK1PDK1
SCHEMBL5728448 0.82 AKT2 (0.67) AKT2PDPK1PDK1
SCHEMBL5728277 0.82 AKT2 (0.75) AKT2PDPK1PDK1
SCHEMBL5728340 0.76 AKT2 (0.85) AKT2PDPK1PDK1
SCHEMBL5728337 0.76 AKT2 (0.85) AKT2PDPK1PDK1
SCHEMBL5728462 0.74 AKT2 (1.00) AKT2PDPK1PDK1
SCHEMBL5728458 0.74 AKT2 (1.00) AKT2PDPK1PDK1
SCHEMBL5728581 0.69 AKT2 (0.58) AKT2PDPK1PDK1

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-1680401-A2 INDOLINONE DERIVATIVES AND THEIR USE IN TREATING DISEASE-STATES SUCH AS CANCER Schering Aktiengesellschaft (DE) 2006-07-19 EP disclosed
WO-2005040116-A2 INDOLINONE DERIVATIVES AND THEIR USE IN TREATING DISEASE-STATES SUCH AS CANCER SCHERING AKTIENGESELLSCHAFT (DE) 2005-05-06 WO disclosed