SCHEMBL612250

SCHEMBL612250

CNc1cc(-c2ccncc2)sc1C(N)=O

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 15/20 0.70
CDC7 O00311 3/20 0.64
DBF4 Q9UBU7 3/20 0.64
MAP2K3 P46734 1/20 0.49
MAPK14 Q16539 1/20 0.49
JAK2 O60674 1/20 0.47
CCNE1 P24864 1/20 0.46
CDK2 P24941 1/20 0.46
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
BTK Q06187 1/20 0.44

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
SCHEMBL611492 0.87 IKBKB (0.52) IKBKBCDC7DBF4
SCHEMBL613270 0.85 KDM4E (0.57) IKBKBCDC7DBF4
SCHEMBL614239 0.85 CDC7 (0.59) IKBKBCDC7DBF4JAK2CCNE1
SCHEMBL613690 0.85 CDC7 (0.59) IKBKBCDC7DBF4JAK2CCNE1
SCHEMBL613122 0.82 CDC7 (0.57) IKBKBCDC7DBF4JAK2CCNE1
SCHEMBL614144 0.80 CDC7 (0.54) IKBKBCDC7DBF4JAK2CDK2
SCHEMBL612267 0.78 CDC7 (1.00) IKBKBCDC7DBF4MAP2K3JAK2
SCHEMBL614262 0.78 CDC7 (0.65) IKBKBCDC7DBF4JAK2CCNE1
Hydrochloric Acid SCHEMBL612294 0.75 IKBKB (0.56) IKBKBCDC7DBF4CCNE1CDK2
SCHEMBL613722 0.72 KDM4E (0.52) IKBKBCDC7DBF4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2403857-B1 THIENOPYRIMIDINE AS CDC7 KINASE INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2013-12-04 EP disclosed
US-20120040981-A1 THIENOPYRIMIDINE AS CDC7 KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-02-16 US disclosed
EP-2403857-A1 THIENOPYRIMIDINE AS CDC7 KINASE INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2012-01-11 EP disclosed
WO-2010101302-A1 THIENOPYRIMIDINE AS CDC7 KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-10 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-20120040981-A1 THIENOPYRIMIDINE AS CDC7 KINASE INHIBITORS CDC7, CDK7, DTYMK IKBKB 993/4885CDC7 1/4885DBF4 593/4885

“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.