SCHEMBL2760379

SCHEMBL2760379

CCc1ncnc2cc[nH]c12

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.53
IRAK4 Q9NWZ3 1/20 0.39
REN P00797 2/20 0.34
EIF4E P06730 1/20 0.34
MKNK1 Q9BUB5 1/20 0.34
MKNK2 Q9HBH9 1/20 0.34
EGFR P00533 7/20 0.33
ERBB2 P04626 7/20 0.33
ERBB3 P21860 7/20 0.33
ERBB4 Q15303 7/20 0.33
BRAF P15056 1/20 0.33
TNNI3K Q59H18 1/20 0.33
MAPK1 P28482 1/20 0.32
AKT1 P31749 1/20 0.30
LPAR1 Q92633 1/20 0.30
LPAR2 Q9HBW0 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
SCHEMBL21524782 0.76 DYRK1A (0.41) DYRK1AIRAK4
SCHEMBL18239045 0.75 CCR8 (0.37) DYRK1AREN
SCHEMBL13186164 0.74 DYRK1A (0.59) DYRK1AIRAK4EIF4EMKNK1MKNK2
SCHEMBL1056424 0.74 DYRK1A (0.59) DYRK1AIRAK4EIF4EMKNK1MKNK2
SCHEMBL20576054 0.73 DYRK1A (0.53) DYRK1AIRAK4EIF4EMKNK1MKNK2
SCHEMBL10171941 0.72 ADORA2A (0.36) DYRK1AREN
SCHEMBL13768011 0.70 KDM4E (0.49) DYRK1AIRAK4MKNK2EGFRERBB2
SCHEMBL23158613 0.69 DYRK1A (0.64) DYRK1AIRAK4EIF4EMKNK1MKNK2
SCHEMBL2078428 0.69 DYRK1A (0.59) DYRK1AIRAK4EIF4EMKNK1MKNK2
SCHEMBL397656 0.69 DYRK1A (0.59) DYRK1AIRAK4EIF4EMKNK1MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8389516-B2 Antibacterial compositions BIOTA EUROPE LIMITED (GB) 2013-03-05 US disclosed
US-20120004221-A1 Antibacterial Compositions BIOTA EUROPE LIMITED (GB) 2012-01-05 US disclosed
US-20110263590-A1 Antibacterial Compositions BIOTA EUROPE LIMITED (GB) 2011-10-27 US disclosed
US-7977340-B2 Antibacterial compositions PROLYSIS LTD. (GB) 2011-07-12 US disclosed
US-20110165183-A1 PIPERIDINE DERIVATIVES AS JAK3 INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2011-07-07 US disclosed
US-20100311766-A1 ANTIBACTERIAL COMPOSITIONS BIOTA EUROPE LTD (GB) 2010-12-09 US disclosed
US-20090197877-A1 Antibacterial Compositions PROLYSIS LTD. (GB) 2009-08-06 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 (5 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-20110165183-A1 PIPERIDINE DERIVATIVES AS JAK3 INHIBITORS JAK3, JAK2, JAK1 DYRK1A 1293/4885IRAK4 44/4885REN 2213/4885
US-20120004221-A1 Antibacterial Compositions CYCS, COX6C, RPS6 DYRK1A 4441/4885IRAK4 4214/4885REN 458/4885
US-20090197877-A1 Antibacterial Compositions CYCS, COX6C, INTS6 DYRK1A 2769/4885IRAK4 3276/4885REN 290/4885
US-20100311766-A1 ANTIBACTERIAL COMPOSITIONS C5, AGK, CYCS DYRK1A 1600/4885IRAK4 1865/4885REN 810/4885
US-20110263590-A1 Antibacterial Compositions CYCS, COX6C, RPS6 DYRK1A 4497/4885IRAK4 4258/4885REN 410/4885

“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.