SCHEMBL8514824

SCHEMBL8514824

CC1CCC(c2ccncc2NC(=O)c2nc(-c3c(F)cccc3F)c(F)cc2N)CC1

nearest known ligand 0.79

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 20/20 0.79
PIM1 P11309 19/20 0.79
PIM2 Q9P1W9 19/20 0.79
GSK3B P49841 1/20 0.57
PRKCQ Q04759 1/20 0.57
KCNH2 Q12809 1/20 0.57
PKN1 Q16512 1/20 0.57

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
SCHEMBL13458218 0.92 PIM3 (0.80) PIM3PIM1PIM2
SCHEMBL13458375 0.92 PIM3 (0.80) PIM3PIM1PIM2
SCHEMBL14235348 0.91 PIM3 (0.90) PIM3PIM1PIM2GSK3BPRKCQ
SCHEMBL3207103 0.88 PIM3 (1.00) PIM3PIM1PIM2GSK3BPRKCQ
SCHEMBL3207094 0.88 PIM3 (1.00) PIM3PIM1PIM2GSK3BPRKCQ
SCHEMBL3227394 0.88 PIM3 (1.00) PIM3PIM1PIM2GSK3BPRKCQ
SCHEMBL3220616 0.86 PIM3 (1.00) PIM3PIM1PIM2
SCHEMBL3208976 0.86 PIM3 (1.00) PIM3PIM1PIM2
SCHEMBL13458206 0.85 PIM3 (0.83) PIM3PIM1PIM2
SCHEMBL3218257 0.85 PIM3 (1.00) PIM3PIM1PIM2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8592455-B2 Kinase inhibitors and methods of their use NOVARTIS AG (CH) 2013-11-26 US disclosed
US-20120134987-A1 KINASE INHIBITORS AND METHODS OF THEIR USE BURGER MATTHEW T (US) 2012-05-31 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-20120134987-A1 KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 PIM3 3/4885PIM1 1/4885PIM2 2/4885

“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.