SCHEMBL14906150

SCHEMBL14906150

CC[C@]1(O)[C@H](O)C[C@H](c2ccncc2NC(=O)c2c[nH]cc(-c3ccccc3)c2=O)O[C@@H]1C

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIM2 Q9P1W9 8/20 0.38
PIM3 Q86V86 4/20 0.38
PIM1 P11309 3/20 0.38
GSK3A P49840 10/20 0.35
MAPT P10636 6/20 0.35
GSK3B P49841 3/20 0.34
CDK2 P24941 1/20 0.34
CDK5 Q00535 1/20 0.34
PRKCQ Q04759 1/20 0.34
AAK1 Q2M2I8 1/20 0.34

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
SCHEMBL1910925 0.82 GSK3A (0.39) PIM2PIM3PIM1GSK3AMAPT
SCHEMBL1911279 0.81 GSK3A (0.35) PIM1GSK3AMAPTGSK3BCDK2
SCHEMBL14891994 0.81 GSK3A (0.35) PIM1GSK3AMAPTGSK3BCDK2
SCHEMBL14891672 0.81 MAPT (0.35) PIM2PIM3PIM1GSK3AMAPT
SCHEMBL14892173 0.81 MAPT (0.35) PIM2PIM3PIM1GSK3AMAPT
SCHEMBL319507 0.80 PIM2 (0.46) PIM2PIM3PIM1MAPTGSK3B
SCHEMBL14906142 0.78 PIM2 (0.52) PIM2PIM3PIM1GSK3BPRKCQ
SCHEMBL14906141 0.78 CYP3A4 (0.51) PIM2PIM3PIM1GSK3B
SCHEMBL1911219 0.77 MAPT (0.37) PIM2PIM3PIM1GSK3AMAPT
SCHEMBL1911277 0.77 MAPT (0.37) PIM2PIM3PIM1GSK3AMAPT

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 PIM2 4/4885PIM3 5/4885PIM1 1/4885

“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.