SCHEMBL1911212

SCHEMBL1911212

NC[C@H]1O[C@@H](c2ccncc2NC(=O)c2ccc(F)c(-c3c(F)cccc3F)n2)C[C@@H](O)[C@@H]1O

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 20/20 0.65
PIM3 Q86V86 20/20 0.65
PIM2 Q9P1W9 20/20 0.65
GSK3B P49841 1/20 0.59
PRKCQ Q04759 1/20 0.59
KCNH2 Q12809 1/20 0.59
PKN1 Q16512 1/20 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
SCHEMBL1911166 0.94 PIM1 (0.57) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL1910958 0.93 PIM1 (0.66) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL1911112 0.93 PIM1 (0.66) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL1911192 0.93 PIM1 (0.66) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL1910840 0.93 PIM1 (0.66) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL319071 0.92 PIM1 (0.64) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL1911187 0.92 PIM1 (0.68) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL14906196 0.91 PIM1 (0.64) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL14906193 0.90 PIM1 (0.65) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL1910895 0.89 PIM1 (0.68) PIM1PIM3PIM2GSK3BPRKCQ

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-2012004217-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS NOVARTIS AG (CH) 2012-01-12 WO disclosed