SCHEMBL613122

SCHEMBL613122

CCCNc1cc(-c2ccncc2)sc1C(N)=O

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 3/20 0.57
DBF4 Q9UBU7 3/20 0.57
IKBKB O14920 11/20 0.52
LIMK1 P53667 1/20 0.48
KDM6B O15054 1/20 0.46
KDM4C Q9H3R0 1/20 0.46
JAK2 O60674 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CCNE1 P24864 1/20 0.41
CDK2 P24941 1/20 0.41
PRKCI P41743 1/20 0.41

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
SCHEMBL614144 0.93 CDC7 (0.54) CDC7DBF4IKBKBLIMK1KDM6B
SCHEMBL613690 0.90 CDC7 (0.59) CDC7DBF4IKBKBJAK2KDM4E
SCHEMBL611071 0.88 KDM6B (0.50) CDC7DBF4IKBKBLIMK1KDM6B
SCHEMBL613988 0.86 KDM4E (0.50) LIMK1KDM4EALDH1A1HPGD
SCHEMBL612250 0.82 IKBKB (0.70) CDC7DBF4IKBKBJAK2CCNE1
SCHEMBL613639 0.81 KDM6B (0.52) CDC7DBF4LIMK1KDM6BKDM4C
SCHEMBL614262 0.80 CDC7 (0.65) CDC7DBF4IKBKBKDM6BKDM4C
SCHEMBL612320 0.79 KDM4E (0.48) KDM6BKDM4CKDM4EALDH1A1HPGD
SCHEMBL614239 0.79 CDC7 (0.59) CDC7DBF4IKBKBJAK2CCNE1
SCHEMBL613433 0.77 PTPN1 (0.48) CDC7DBF4IKBKBKDM4EALDH1A1

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 2 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

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 CDC7 1/4885DBF4 593/4885IKBKB 993/4885

“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.