SCHEMBL12645604

SCHEMBL12645604

CC1CC1C(=O)N[C@H]1CC[C@H](Nc2nc(NC3CC3)n3ncc(/C=C4\NC(=O)NC4=O)c3n2)CC1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 4/20 0.35
TTK P33981 6/20 0.34
CYP3A4 P08684 1/20 0.33
MAPK8 P45983 4/20 0.33
MAPK9 P45984 4/20 0.33
MAPK10 P53779 4/20 0.33
CSNK2B P67870 2/20 0.32
CDK2 P24941 4/20 0.32
CDK9 P50750 4/20 0.32
CDK4 P11802 1/20 0.31
CDK7 P50613 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
SCHEMBL12645369 0.89 CSNK2A1 (0.41) CSNK2A1TTKCYP3A4MAPK8MAPK9
SCHEMBL12644899 0.88 TTK (0.36) CSNK2A1TTKCYP3A4MAPK8MAPK9
SCHEMBL12644721 0.87 CSNK2B (0.38) CSNK2A1TTKMAPK8MAPK9MAPK10
SCHEMBL12645620 0.86 JAK2 (0.35) CSNK2A1TTKCYP3A4MAPK8MAPK9
SCHEMBL12645072 0.86 CDK2 (0.39) CSNK2A1TTKCYP3A4MAPK8MAPK9
SCHEMBL12644914 0.85 CSNK2A1 (0.35) CSNK2A1TTKCYP3A4MAPK8MAPK9
SCHEMBL2030474 0.85 MAPK8 (0.37) CSNK2A1TTKMAPK8MAPK9MAPK10
SCHEMBL2030477 0.85 MAPK8 (0.37) CSNK2A1TTKMAPK8MAPK9MAPK10
SCHEMBL2030472 0.85 MAPK8 (0.37) CSNK2A1TTKMAPK8MAPK9MAPK10
SCHEMBL12644942 0.85 MAPK8 (0.39) CSNK2A1TTKMAPK8MAPK9MAPK10

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-9303033-B2 Pyrazolopyrimidines and related heterocycles as CK2 inhibitors SENHWA BIOSCIENCES, INC. (TW) 2016-04-05 US disclosed
US-8575177-B2 Pyrazolopyrimidines and related heterocycles as CK2 inhibitors SENHWA BIOSCIENCES, INC. (TW) 2013-11-05 US disclosed
US-20110152240-A1 PYRAZOLOPYRIMIDINES AND RELATED HETEROCYCLES AS CK2 INHIBITORS CYLENE PHARMACEUTICALS, INC. (US) 2011-06-23 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-20110152240-A1 PYRAZOLOPYRIMIDINES AND RELATED HETEROCYCLES AS CK2 INHIBITORS CDK2, CKS2, CSNK2A1 CSNK2A1 3/4885TTK 87/4885CYP3A4 1892/4885

“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.