SCHEMBL4457320

SCHEMBL4457320

Cc1cc(CNC2=NC(OCCN3CCCC3)=CC(N)(c3cc(C4CC4)[nH]n3)N2)on1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 19/20 0.56
NTRK1 P04629 1/20 0.40
CDK2 P24941 1/20 0.40
NTRK2 Q16620 1/20 0.40

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
SCHEMBL4455003 0.74 IGF1R (0.59) IGF1R
SCHEMBL1792487 0.72 IGF1R (0.64) IGF1RNTRK1CDK2NTRK2
SCHEMBL4923964 0.72 IGF1R (1.00) IGF1R
SCHEMBL4458844 0.70 IGF1R (0.54) IGF1RNTRK1
SCHEMBL4015974 0.64 IGF1R (1.00) IGF1R
SCHEMBL1792868 0.63 IGF1R (0.65) IGF1RNTRK1
SCHEMBL4099567 0.63 IGF1R (0.65) IGF1RNTRK1
SCHEMBL4468090 0.63 IGF1R (1.00) IGF1RNTRK1
SCHEMBL4467729 0.62 IGF1R (0.42) IGF1R
SCHEMBL4558721 0.62 IGF1R (0.78) 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