SCHEMBL4557014

SCHEMBL4557014

CN1CCC(OC2=CC(N)(c3cc(C4CC4)[nH]n3)N=C(NCc3cc(-c4ccccc4)no3)N2)CC1

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
SCHEMBL4558703 0.77 IGF1R (0.59) IGF1R
SCHEMBL11342739 0.75 IGF1R (1.00) IGF1R
SCHEMBL11342819 0.71 IGF1R (1.00) IGF1R
SCHEMBL4557061 0.69 IGF1R (0.68) IGF1R
SCHEMBL11350577 0.68 IGF1R (1.00) IGF1R
SCHEMBL11342762 0.67 IGF1R (1.00) IGF1R
SCHEMBL1794878 0.66 IGF1R (0.67) IGF1R
SCHEMBL11351475 0.65 IGF1R (1.00) IGF1R
SCHEMBL11346816 0.65 IGF1R (1.00) IGF1R
SCHEMBL11340066 0.64 IGF1R (1.00) 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