SCHEMBL2739652

SCHEMBL2739652

CC(C)(C)c1ncnc2cc[nH]c12

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.53
IRAK4 Q9NWZ3 1/20 0.39
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
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL20506184 0.85 DYRK1A (0.55) DYRK1AIRAK4EIF4EMKNK1MKNK2
SCHEMBL13186164 0.74 DYRK1A (0.59) DYRK1AIRAK4EIF4EMKNK1MKNK2
SCHEMBL10139171 0.72 DYRK1A (0.32) DYRK1A
SCHEMBL3386908 0.69 DYRK1A (0.59) DYRK1AIRAK4EIF4EMKNK1MKNK2
SCHEMBL397656 0.69 DYRK1A (0.59) DYRK1AIRAK4EIF4EMKNK1MKNK2
SCHEMBL23158613 0.69 DYRK1A (0.64) DYRK1AIRAK4EIF4EMKNK1MKNK2
SCHEMBL1056424 0.69 DYRK1A (0.59) DYRK1AIRAK4EIF4EMKNK1MKNK2
SCHEMBL8223 0.69 DYRK1A (1.00) DYRK1AIRAK4EIF4EMKNK1MKNK2
SCHEMBL2078428 0.69 DYRK1A (0.59) DYRK1AIRAK4EIF4EMKNK1MKNK2
SCHEMBL20712736 0.69 MAPK1 (0.41) DYRK1AIRAK4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265107-A1 PB2 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF SICHUAN HAISCO PHARMACEUTICAL CO., LTD. (CN) 2023-08-24 US disclosed
US-20230265107-A1 PB2 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF SICHUAN HAISCO PHARMACEUTICAL CO., LTD. (CN) 2023-08-24 US disclosed
EP-3765458-B1 O-GLYCOPROTEIN-2-ACETAMIDO-2-DEOXY-3-D-GLYCOPYRANOSIDASE INHIBITORS BIOGEN MA INC (US) 2023-01-11 EP disclosed
US-11208411-B2 Compositions and methods for treating parasitic diseases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-12-28 US disclosed
US-20200291030-A1 COMPOSITIONS AND METHODS FOR TREATING PARASITIC DISEASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-09-17 US disclosed
US-8481544-B2 Antibacterial compositions BIOTA EUROPE LIMITED (GB) 2013-07-09 US disclosed
US-8389516-B2 Antibacterial compositions BIOTA EUROPE LIMITED (GB) 2013-03-05 US disclosed
US-20120053183-A1 PIPERAZINYLPYRIMIDINE ANALOGUES AS PROTEIN KINASE INHIBITORS UNIVERSITY OF THE PACIFIC (US) 2012-03-01 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-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 (8 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-20120004221-A1 Antibacterial Compositions CYCS, COX6C, RPS6 DYRK1A 4441/4885IRAK4 4214/4885EIF4E 2537/4885
US-20090197877-A1 Antibacterial Compositions CYCS, COX6C, INTS6 DYRK1A 2769/4885IRAK4 3276/4885EIF4E 3282/4885
US-20200291030-A1 COMPOSITIONS AND METHODS FOR TREATING PARASITIC DISEASES LIPA, LSS, LIPC DYRK1A 3323/4885IRAK4 2988/4885EIF4E 4695/4885
US-20230265107-A1 PB2 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF CYP11B2, WEE2, CYP11B1 DYRK1A 919/4885IRAK4 4445/4885EIF4E 4161/4885
US-20100311766-A1 ANTIBACTERIAL COMPOSITIONS C5, AGK, CYCS DYRK1A 1600/4885IRAK4 1865/4885EIF4E 1442/4885
US-11208411-B2 Compositions and methods for treating parasitic diseases LIPA, LSS, LIPC DYRK1A 3323/4885IRAK4 2988/4885EIF4E 4695/4885
US-20120053183-A1 PIPERAZINYLPYRIMIDINE ANALOGUES AS PROTEIN KINASE INHIBITORS DCK, PAK5, CDK2 DYRK1A 704/4885IRAK4 981/4885EIF4E 538/4885
US-20110263590-A1 Antibacterial Compositions CYCS, COX6C, RPS6 DYRK1A 4497/4885IRAK4 4258/4885EIF4E 2514/4885

“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.