SCHEMBL4442437

SCHEMBL4442437

CCc1cc(B2OC(C)(C)C(C)(C)O2)cc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)n1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.43
BACE2 Q9Y5Z0 1/20 0.43
USP30 Q70CQ3 2/20 0.42
PRMT5 O14744 1/20 0.37
WDR77 Q9BQA1 1/20 0.37
AAK1 Q2M2I8 2/20 0.35
DGAT1 O75907 1/20 0.34
HIF1A Q16665 2/20 0.33
FFAR1 O14842 1/20 0.33
GSK3A P49840 1/20 0.30
GSK3B P49841 1/20 0.30
F2 P00734 1/20 0.30
F11 P03951 1/20 0.30
PRSS1 P07477 1/20 0.30
PRSS2 P07478 1/20 0.30
PRSS3 P35030 1/20 0.30
SYK P43405 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
SCHEMBL24270226 0.80 USP30 (0.37) BACE1BACE2USP30PRMT5WDR77
SCHEMBL21672314 0.78 BACE1 (0.49) BACE1BACE2USP30PRMT5WDR77
SCHEMBL15386256 0.76 USP30 (0.50) BACE1BACE2USP30PRMT5WDR77
SCHEMBL4435448 0.75 SYK (0.37) SYK
SCHEMBL31198038 0.74 LPL (0.44) DGAT1FFAR1F11
SCHEMBL31530977 0.73 SYK (0.39) SYK
SCHEMBL26728111 0.72 BACE1 (0.42) BACE1BACE2USP30PRMT5WDR77
SCHEMBL799138 0.72 USP30 (0.53) BACE1BACE2USP30PRMT5WDR77
SCHEMBL12446651 0.71 USP30 (0.47) BACE1BACE2USP30PRMT5WDR77
SCHEMBL12446647 0.71 USP30 (0.47) BACE1BACE2USP30PRMT5WDR77

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 6 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-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
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 BACE1 3510/4885BACE2 3818/4885USP30 3319/4885
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 BACE1 3510/4885BACE2 3818/4885USP30 3319/4885

“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.