SCHEMBL4558746

SCHEMBL4558746

CC(C)(C)[CH]c1ccc(Nc2ncc(Br)c(Nc3cc(C4CC4)[nH]n3)n2)cc1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 20/20 0.72

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
SCHEMBL11341250 0.84 IGF1R (1.00) IGF1R
SCHEMBL11339535 0.83 IGF1R (1.00) IGF1R
SCHEMBL11346404 0.83 IGF1R (0.82) IGF1R
SCHEMBL11342377 0.82 IGF1R (0.88) IGF1R
SCHEMBL11338910 0.82 IGF1R (1.00) IGF1R
SCHEMBL11343486 0.80 IGF1R (0.83) IGF1R
SCHEMBL11344983 0.79 IGF1R (1.00) IGF1R
SCHEMBL11932243 0.79 IGF1R (1.00) IGF1R
SCHEMBL11340935 0.79 IGF1R (1.00) IGF1R
SCHEMBL11338898 0.79 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