SCHEMBL318869

SCHEMBL318869

COC(=O)c1ccc(F)c(-c2c(F)ccc(C=O)c2F)n1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 3/20 0.40
PIM2 Q9P1W9 10/20 0.36
PIM1 P11309 9/20 0.36
PIM3 Q86V86 9/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.34
ALDH1A1 P00352 1/20 0.33
GSK3B P49841 1/20 0.32
PRKCQ Q04759 1/20 0.32
KCNH2 Q12809 1/20 0.32
PKN1 Q16512 1/20 0.32

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
SCHEMBL12078550 0.88 PIM2 (0.35) ERN1PIM2PIM1PIM3MAPT
SCHEMBL1711596 0.82 PIM1 (0.44) PIM2PIM1PIM3MAPTMAPK1
SCHEMBL320431 0.81 MAPT (0.37) PIM2PIM1PIM3MAPTMAPK1
SCHEMBL29599827 0.81 PIM2 (0.46) PIM2PIM1PIM3MAPTMAPK1
SCHEMBL15872950 0.81 PIM2 (0.46) PIM2PIM1PIM3MAPTMAPK1
SCHEMBL29600679 0.80 MAPT (0.47) PIM2PIM1PIM3MAPTGSK3B
SCHEMBL15872828 0.80 MAPT (0.47) PIM2PIM1PIM3MAPTGSK3B
SCHEMBL12078471 0.80 ALDH1A1 (0.40) ERN1PIM2PIM1PIM3MAPT
SCHEMBL319384 0.78 IAPP (0.46) PIM2PIM1PIM3MAPTALDH1A1
SCHEMBL319082 0.78 GAA (0.38) PIM2PIM1PIM3MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2681195-A1 NOVEL KINASE INHIBITORS Novartis AG (CH) 2014-01-08 EP disclosed
EP-2590968-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS Novartis AG (CH) 2013-05-15 EP disclosed
US-20130109682-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS NOVARTIS AG (CH) 2013-05-02 US disclosed
US-20130109682-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS NOVARTIS AG (CH) 2013-05-02 US disclosed
US-20130109682-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS NOVARTIS AG (CH) 2013-05-02 US disclosed
WO-2012120428-A1 NOVEL KINASE INHIBITORS NOVARTIS AG (CH) 2012-09-13 WO disclosed
WO-2012120428-A1 NOVEL KINASE INHIBITORS NOVARTIS AG (CH) 2012-09-13 WO disclosed
US-20120225062-A1 NOVEL KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2012-09-06 US disclosed
US-20120225062-A1 NOVEL KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2012-09-06 US disclosed
US-20120225062-A1 NOVEL KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2012-09-06 US disclosed
WO-2012004217-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS NOVARTIS AG (CH) 2012-01-12 WO disclosed
WO-2012004217-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS NOVARTIS AG (CH) 2012-01-12 WO 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 (2 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-20120225062-A1 NOVEL KINASE INHIBITORS PIM1, PIM2, PIM3 ERN1 394/4885PIM2 2/4885PIM1 1/4885
US-20130109682-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS PIM1, GSK3A, GSK3B ERN1 778/4885PIM2 4/4885PIM1 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.