SCHEMBL4250047

SCHEMBL4250047

CC(C)Cn1cc(-c2ccc3ccn4c(=O)[nH]nc4c3c2)cn1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 8/20 0.55
WDR77 Q9BQA1 8/20 0.55
PIM1 P11309 2/20 0.38
PIM3 Q86V86 1/20 0.38
PIM2 Q9P1W9 1/20 0.38
KDM5B Q9UGL1 2/20 0.37
USP30 Q70CQ3 1/20 0.37
JAK2 O60674 1/20 0.36
KDM5A P29375 1/20 0.36
PDPK1 O15530 1/20 0.36
PIK3CA P42336 1/20 0.36
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
GSK3B P49841 1/20 0.35
DYRK1A Q13627 1/20 0.35
NAMPT P43490 1/20 0.35
TTK P33981 1/20 0.35
MAPK8 P45983 1/20 0.35

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
SCHEMBL4239492 0.82 PRMT5 (0.49) PRMT5WDR77PIK3CAGSK3BDYRK1A
SCHEMBL4517652 0.75 LTK (0.39) PIM1PIM2DYRK1A
SCHEMBL4509185 0.74 CHEK1 (0.44) JAK2PDPK1DYRK1A
SCHEMBL4517754 0.73 CHEK1 (0.47) PIM1PIM3PIM2GSK3BDYRK1A
SCHEMBL4491588 0.73 CHEK1 (0.40) PRMT5WDR77DYRK1A
SCHEMBL4506161 0.72 CHEK1 (0.47) PRMT5WDR77PIM1JAK2GSK3B
SCHEMBL23087704 0.71 PRMT5 (1.00) PRMT5WDR77
SCHEMBL29943019 0.71 PRMT5 (1.00) PRMT5WDR77
SCHEMBL4496917 0.71 CHEK1 (0.47) PIM1PIM2GSK3BDYRK1A
SCHEMBL4499252 0.71 CHEK1 (0.47) GSK3BDYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2013212-A1 TRIAZOLOQUINAZOLINONE DERIVATIVES AS INHIBITORS OF CHECKPOINT KINASES Merck & Co., Inc. (US) 2009-01-14 EP claimed
WO-2007127138-A1 TRIAZOLOQUINAZOLINONE DERIVATIVES AS INHIBITORS OF CHECKPOINT KINASES MERCK & CO., INC. (US) 2007-11-08 WO claimed
US-7501435-B2 Inhibitors of checkpoint kinases MERCK & CO., INC. (US) 2009-03-10 US disclosed
US-7501435-B2 Inhibitors of checkpoint kinases MERCK & CO., INC. (US) 2009-03-10 US disclosed
US-7501435-B2 Inhibitors of checkpoint kinases MERCK & CO., INC. (US) 2009-03-10 US disclosed
EP-2013212-A1 TRIAZOLOQUINAZOLINONE DERIVATIVES AS INHIBITORS OF CHECKPOINT KINASES Merck & Co., Inc. (US) 2009-01-14 EP disclosed
WO-2007127138-A1 TRIAZOLOQUINAZOLINONE DERIVATIVES AS INHIBITORS OF CHECKPOINT KINASES MERCK & CO., INC. (US) 2007-11-08 WO disclosed
WO-2007127138-A1 TRIAZOLOQUINAZOLINONE DERIVATIVES AS INHIBITORS OF CHECKPOINT KINASES MERCK & CO., INC. (US) 2007-11-08 WO disclosed
US-20070254879-A1 Inhibitors of checkpoint kinases MERCK SHARP & DOHME CORP. 2007-11-01 US disclosed
US-20070254879-A1 Inhibitors of checkpoint kinases MERCK SHARP & DOHME CORP. 2007-11-01 US disclosed
US-20070254879-A1 Inhibitors of checkpoint kinases MERCK SHARP & DOHME CORP. 2007-11-01 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 (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-20070254879-A1 Inhibitors of checkpoint kinases CHEK1, CHEK2, PLK1 PRMT5 1243/4885WDR77 916/4885PIM1 1009/4885

“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.