SCHEMBL14040784

SCHEMBL14040784

COc1cc2c(Nc3ccc(Oc4ccncc4)cc3)c(N)cnc2cc1OCCCN1CCOCC1

nearest known ligand 0.79

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 16/20 0.79
RAF1 P04049 2/20 0.68
MAPK3 P27361 1/20 0.68
MAPK1 P28482 1/20 0.68
SRC P12931 2/20 0.61
FGFR2 P21802 1/20 0.56
IGF1R P08069 1/20 0.56
EGFR P00533 1/20 0.55
ERBB2 P04626 1/20 0.55
ABL1 P00519 1/20 0.55
BCR P11274 1/20 0.55

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
SCHEMBL14040749 0.93 MAP2K1 (0.79) MAP2K1RAF1MAPK3MAPK1SRC
SCHEMBL6993386 0.88 MAP2K1 (1.00) MAP2K1RAF1MAPK3MAPK1SRC
SCHEMBL4447904 0.86 MAP2K1 (0.72) MAP2K1RAF1MAPK3MAPK1SRC
SCHEMBL14155226 0.86 MAP2K1 (0.67) MAP2K1RAF1MAPK3MAPK1SRC
SCHEMBL12856346 0.81 MAP2K1 (0.80) MAP2K1RAF1MAPK3MAPK1SRC
SCHEMBL6991654 0.81 MAP2K1 (0.87) MAP2K1RAF1MAPK3MAPK1SRC
SCHEMBL346145 0.81 MAP2K1 (1.00) MAP2K1RAF1MAPK3MAPK1SRC
SCHEMBL4448781 0.80 MAP2K1 (0.84) MAP2K1RAF1MAPK3MAPK1SRC
SCHEMBL4447835 0.79 MAP2K1 (0.64) MAP2K1RAF1MAPK3MAPK1SRC
SCHEMBL14040731 0.79 SRC (0.78) MAP2K1SRCEGFRERBB2ABL1

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-1975620-A2 Three hybrid assay system GPC Biotech AG (DE) 2008-10-01 EP disclosed