SCHEMBL14906138

SCHEMBL14906138

CC1(C)C[C@@H](N)C[C@H](c2ccncc2NC(=O)c2ccc(F)c(-c3c(F)cccc3F)n2)O1

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 20/20 0.74
PIM3 Q86V86 20/20 0.74
PIM2 Q9P1W9 20/20 0.74
GSK3B P49841 1/20 0.66
PRKCQ Q04759 1/20 0.66
KCNH2 Q12809 1/20 0.66
PKN1 Q16512 1/20 0.66

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
SCHEMBL14906209 1.00 PIM1 (0.74) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL14906143 0.92 PIM1 (0.65) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL14892422 0.87 PIM1 (0.63) PIM1PIM3PIM2
SCHEMBL14891661 0.87 PIM1 (0.66) PIM1PIM3PIM2
SCHEMBL14906162 0.85 PIM1 (0.65) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL14906104 0.85 PIM1 (0.65) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL14906106 0.85 PIM1 (0.65) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL14906107 0.85 PIM1 (0.65) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL14892218 0.85 PIM1 (0.66) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL14891442 0.85 PIM1 (0.73) 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
US-20130109682-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS NOVARTIS AG (CH) 2013-05-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130109682-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS PIM1, GSK3A, GSK3B PIM1 1/4885PIM3 5/4885PIM2 4/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.