SCHEMBL4435998

SCHEMBL4435998

CC(C)(C)[Si](C)(C)OC1CCCN(c2ccncc2N)C1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
PIM2 Q9P1W9 12/20 0.36
PIM3 Q86V86 8/20 0.36
PIM1 P11309 7/20 0.36
KDM4E B2RXH2 1/20 0.34
HTT P42858 1/20 0.34
MAP4K4 O95819 1/20 0.34
PBRM1 Q86U86 2/20 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
SCHEMBL11907738 1.00 MAPT (0.40) MAPTPIM2PIM3PIM1KDM4E
SCHEMBL4555535 1.00 MAPT (0.40) MAPTPIM2PIM3PIM1KDM4E
SCHEMBL15992109 0.82 CDK8 (0.36) PIM2PIM3PIM1MAP4K4PBRM1
SCHEMBL15992108 0.82 CDK8 (0.36) PIM2PIM3PIM1MAP4K4PBRM1
SCHEMBL15992232 0.82 CDK8 (0.36) PIM2PIM3PIM1MAP4K4PBRM1
SCHEMBL11906559 0.81 ALDH1A1 (0.42) MAPTHTT
SCHEMBL4433633 0.81 ALDH1A1 (0.42) MAPTHTT
SCHEMBL4565720 0.81 ALDH1A1 (0.42) MAPTHTT
SCHEMBL13734479 0.81 ROCK2 (0.30)
SCHEMBL13734669 0.81 ROCK2 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140249135-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2014-09-04 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-8822497-B2 PIM kinase inhibitors and methods of their use NOVARTIS AG (CH) 2014-09-02 US disclosed
EP-2132177-B1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2013-07-17 EP disclosed
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2012-08-16 US disclosed
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2012-08-16 US disclosed
EP-2132177-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE Novartis Ag (CH) 2009-12-16 EP disclosed
WO-2008106692-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-09-04 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-20140249135-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 MAPT 4106/4885PIM2 2/4885PIM3 3/4885
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 MAPT 4106/4885PIM2 2/4885PIM3 3/4885

“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.