SCHEMBL12645142

SCHEMBL12645142

Cc1ccc(F)c(Nc2cc(NCC(C)N3CCOCC3)n3ncc(C=O)c3n2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 8/20 0.37
CSNK2B P67870 2/20 0.36
CDK2 P24941 1/20 0.34
CDK9 P50750 1/20 0.34
LMNA P02545 2/20 0.34
KDM4E B2RXH2 3/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
KMT2A Q03164 2/20 0.34
HSD17B10 Q99714 2/20 0.34
USP2 O75604 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
CSNK2A2 P19784 1/20 0.33
KCNH2 Q12809 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.32

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
SCHEMBL2028474 0.92 CSNK2B (0.43) TYK2CSNK2BCDK2CDK9KDM4E
SCHEMBL2029617 0.79 CSNK2B (0.48) TYK2CSNK2BKDM4ENPC1RAB9A
SCHEMBL12587708 0.79 CSNK2B (0.48) TYK2CSNK2BKDM4ENPC1RAB9A
SCHEMBL2029618 0.79 CSNK2B (0.48) TYK2CSNK2BKDM4ENPC1RAB9A
SCHEMBL2028002 0.75 MAPKAPK2 (0.43) TYK2CDK2CDK9KDM4ENPC1
SCHEMBL1487862 0.68 CSNK2B (0.62) TYK2CSNK2BCDK2CSNK2A2KCNH2
SCHEMBL12841015 0.68 CSNK2B (0.61) TYK2CSNK2BCDK2CSNK2A2KCNH2
SCHEMBL1528130 0.67 CSNK2B (0.60) TYK2CSNK2BCDK2CSNK2A2KCNH2
SCHEMBL12841018 0.66 CSNK2B (0.44) TYK2CSNK2BCDK2CSNK2A2KCNH2
SCHEMBL23903267 0.66 KCNH2 (0.46) TYK2CSNK2BCDK2CSNK2A2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 TYK2 63/4885CSNK2B 13/4885CDK2 1/4885

“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.