SCHEMBL4455003

SCHEMBL4455003

CN(C)CCOC1=CC(N)(c2cc(C3CC3)[nH]n2)NC(NCc2cc(-c3ccncn3)no2)=N1

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 20/20 0.59

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
SCHEMBL1790304 0.75 IGF1R (0.67) IGF1R
SCHEMBL11344134 0.74 IGF1R (1.00) IGF1R
SCHEMBL4457320 0.74 IGF1R (0.56) IGF1R
SCHEMBL14311660 0.67 IGF1R (0.67) IGF1R
SCHEMBL1790693 0.66 IGF1R (0.67) IGF1R
SCHEMBL1789191 0.65 IGF1R (0.68) IGF1R
SCHEMBL11346989 0.65 IGF1R (1.00) IGF1R
SCHEMBL4458844 0.64 IGF1R (0.54) IGF1R
SCHEMBL11346815 0.63 IGF1R (1.00) IGF1R
SCHEMBL1791604 0.62 IGF1R (0.67) IGF1R

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-2009017838-A2 COMBINATIONS OF JAK-2 INHIBITORS AND OTHER AGENTS EXELIXIS, INC. (US) 2009-02-05 WO claimed