SCHEMBL6071072

SCHEMBL6071072

CSc1nccc(-c2ccnn2-c2ccccc2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.41
DYRK3 O43781 1/20 0.41
DYRK2 Q92630 1/20 0.41
MAPK14 Q16539 2/20 0.41
MAPK13 O15264 1/20 0.41
MAPK12 P53778 1/20 0.41
MAPK11 Q15759 1/20 0.41
CSNK1E P49674 1/20 0.41
KDM4E B2RXH2 4/20 0.40
NPSR1 Q6W5P4 3/20 0.40
POLB P06746 3/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 3/20 0.40
MAPT P10636 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
MAPK1 P28482 1/20 0.39
MDM2 Q00987 1/20 0.39
NR3C2 P08235 1/20 0.39

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
SCHEMBL27313007 0.78 HSP90AA1 (0.53) DYRK1AMAPK14MAPK13MAPK12MAPK11
SCHEMBL27315070 0.78 POLB (0.42) MAPK14KDM4EPOLBALDH1A1MAPT
SCHEMBL19924519 0.77 PDE10A (0.44) MAPK14MAPK13MAPK12MAPK11NPSR1
SCHEMBL6070872 0.75 MDM2 (0.40) DYRK1ADYRK2NPSR1POLBHPGD
SCHEMBL7256639 0.75 MDM2 (0.38) MAPK14KDM4EPOLBALDH1A1MDM2
SCHEMBL28606518 0.75 DYRK1A (0.45) DYRK1ADYRK3DYRK2MAPK14MAPK13
SCHEMBL6071216 0.74 KDM4E (0.56) DYRK1ADYRK3DYRK2MAPK14MAPK13
SCHEMBL12491441 0.74 CCNK (0.45) DYRK1ADYRK3DYRK2MAPK14MAPK13
SCHEMBL1034731 0.73 DUSP10 (0.54) MAPK14MAPK13MAPK12MAPK11CSNK1E
SCHEMBL27309749 0.71 MAPK9 (0.48) MAPK14MAPK13MAPK12MAPK11KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7109204-B2 controlling signal transduction; anticancer agents, antitumor agents, atherosclerosis, vision defects, antidiabetic agents, antiinflammatory agents MERCK & CO., INC. (US) 2006-09-19 US disclosed
US-20040235875-A1 drugs used for signal transduction modulation, and for prophylaxis of angiogenesis, cancers, tumors, atherosclerosis, vision disorders and inflammatory diseases in mammals MERCK SHARP & DOHME CORP. 2004-11-25 US disclosed
WO-2003011837-A1 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2003-02-13 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 (1 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-20040235875-A1 drugs used for signal transduction modulation, and for prophylaxis of angiogenesis, cancers, tumors, atherosclerosis, vision disorders and inflammatory diseases in mammals FLT4, KDR, FLT1 DYRK1A 1306/4885DYRK3 1403/4885DYRK2 1085/4885

“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.