SCHEMBL2279254

SCHEMBL2279254

CC(C)(C)[Si](C)(C)OCC1CC(NC(=O)O)CN(c2ccncc2N)C1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 7/20 0.38
MAPT P10636 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
SSTR4 P31391 1/20 0.31
PIM2 Q9P1W9 3/20 0.31
PIM1 P11309 2/20 0.31
PIM3 Q86V86 2/20 0.31
RBP4 P02753 1/20 0.31
GRM4 Q14833 1/20 0.30
MMP2 P08253 2/20 0.30
ANPEP P15144 2/20 0.30
ARG1 P05089 1/20 0.30
ARG2 P78540 1/20 0.30

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
SCHEMBL4127124 0.90 MAP4K4 (0.37) CHRM4
SCHEMBL1710192 0.86 CHRM4 (0.33) CHRM4MAPTALDH1A1
SCHEMBL1710197 0.86 CHRM4 (0.33) CHRM4MAPTALDH1A1
SCHEMBL2694226 0.85 CHRM4 (0.36) CHRM4MAPTKDM4EALDH1A1GLA
SCHEMBL14972630 0.85 CHRM4 (0.36) CHRM4MAPTKDM4EALDH1A1GLA
SCHEMBL14972628 0.85 CHRM4 (0.36) CHRM4MAPTKDM4EALDH1A1GLA
SCHEMBL15327629 0.84 CHRM4 (0.41) CHRM4MAPTKDM4EALDH1A1GLA
SCHEMBL11899488 0.84 CHRM4 (0.41) CHRM4MAPTKDM4EALDH1A1GLA
SCHEMBL15327628 0.84 CHRM4 (0.41) CHRM4MAPTKDM4EALDH1A1GLA
SCHEMBL2849589 0.82 KDM4E (0.32) MAPTKDM4EALDH1A1GLAGAA

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
US-8829193-B2 PIM kinase inhibitors and methods of their use NOVARTIS AG (CH) 2014-09-09 US disclosed
US-20140249135-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2014-09-04 US disclosed
US-8822497-B2 PIM kinase inhibitors and methods of their use NOVARTIS AG (CH) 2014-09-02 US disclosed
US-8759338-B2 Heterocyclic kinase inhibitors NOVARTIS AG (CH) 2014-06-24 US disclosed
EP-2344473-B1 HETEROCYCLIC PIM-KINASE INHIBITORS NOVARTIS AG (CH) 2014-04-16 EP disclosed
EP-2262802-B1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2013-10-23 EP disclosed
EP-2132177-B1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2013-07-17 EP disclosed
EP-2596790-A1 Pim kinase inhibitors and methods of their use Novartis AG (CH) 2013-05-29 EP disclosed
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2012-08-16 US disclosed
US-20120202851-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2012-08-09 US disclosed
US-8168794-B2 Pim kinase inhibitors and methods of their use NOVARTIS AG (CH) 2012-05-01 US disclosed
US-20110195956-A1 Heterocyclic Kinase Inhibitors NOVARTIS AG (CH) 2011-08-11 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 (4 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-20140249135-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 CHRM4 4538/4885MAPT 4106/4885KDM4E 946/4885
US-20120202851-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 CHRM4 4728/4885MAPT 978/4885KDM4E 1409/4885
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 CHRM4 4538/4885MAPT 4106/4885KDM4E 946/4885
US-20110195956-A1 Heterocyclic Kinase Inhibitors PIM1, PIM2, PIM3 CHRM4 4588/4885MAPT 3442/4885KDM4E 642/4885

“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.