SCHEMBL12645801

SCHEMBL12645801

CC(C)(C)OC(=O)NC1CCC(Nc2nc(N(C(=O)OC(C)(C)C)C3CC3)n3ncc(/C=C4\NC(=O)NC4=O)c3n2)CC1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 1/20 0.33
PIM1 P11309 1/20 0.33
PIM3 Q86V86 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
PIK3CA P42336 1/20 0.31
MTOR P42345 1/20 0.31
PRKDC P78527 1/20 0.31
JAK1 P23458 2/20 0.30
CKS1B P61024 1/20 0.30
SKP1 P63208 1/20 0.30
SKP2 Q13309 1/20 0.30
KDM1A O60341 1/20 0.30
MAOB P27338 1/20 0.30
JAK2 O60674 1/20 0.30

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
SCHEMBL15368816 0.86 CSNK2B (0.36) MERTKPIM1PIM3PIM2PIK3CA
SCHEMBL2032996 0.79 CSNK2B (0.32)
SCHEMBL2032992 0.79 CSNK2B (0.32)
SCHEMBL2051265 0.78 CSNK2B (0.38)
SCHEMBL2051260 0.78 CSNK2B (0.38)
SCHEMBL12645369 0.74 CSNK2A1 (0.41)
SCHEMBL12644853 0.73 TTK (0.35)
SCHEMBL12645604 0.73 CSNK2A1 (0.35)
SCHEMBL12644721 0.72 CSNK2B (0.38)
SCHEMBL12645171 0.72 CSNK2B (0.50)

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
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 MERTK 763/4885PIM1 532/4885PIM3 739/4885

“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.