SCHEMBL384871

SCHEMBL384871

COc1cc(-c2cc(-c3ccccc3)[nH]c(=O)n2)ccc1O

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCL12 P48061 1/20 0.80
CDC7 O00311 4/20 0.71
PIM1 P11309 3/20 0.71
GSK3B P49841 2/20 0.71
CSNK2A1 P68400 2/20 0.71
CSNK2A2 P19784 1/20 0.71
CLK1 P49759 1/20 0.71
CSNK2B P67870 1/20 0.71
CSNK2A3 Q8NEV1 1/20 0.71
KDM4E B2RXH2 2/20 0.67
ALDH1A1 P00352 1/20 0.61
HPGD P15428 1/20 0.61
HSD17B10 Q99714 1/20 0.61
CYP1A1 P04798 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP1B1 Q16678 1/20 0.54
FGFR1 P11362 2/20 0.53
CDK2 P24941 2/20 0.53
MAPK13 O15264 1/20 0.53
DAPK3 O43293 1/20 0.53

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
SCHEMBL19782359 0.95 CXCL12 (0.72) CXCL12CDC7PIM1GSK3BCSNK2A1
SCHEMBL19782903 0.89 CXCL12 (1.00) CXCL12CDC7PIM1GSK3BCSNK2A1
SCHEMBL29838763 0.89 CXCL12 (1.00) CXCL12CDC7PIM1GSK3BCSNK2A1
SCHEMBL19783008 0.86 CXCL12 (0.74) CXCL12CDC7PIM1GSK3BCSNK2A1
SCHEMBL19782360 0.86 CXCL12 (0.74) CXCL12CDC7PIM1GSK3BCSNK2A1
SCHEMBL19782905 0.86 CXCL12 (0.67) CXCL12CDC7PIM1GSK3BCSNK2A1
SCHEMBL19782361 0.85 CXCL12 (0.66) CXCL12CDC7PIM1GSK3BCSNK2A1
SCHEMBL19782920 0.85 CXCL12 (0.72) CXCL12CDC7PIM1GSK3BCSNK2A1
SCHEMBL19782680 0.85 CXCL12 (0.72) CXCL12CDC7PIM1GSK3BCSNK2A1
SCHEMBL19782824 0.84 CXCL12 (0.68) CXCL12CDC7PIM1GSK3BCSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101625-B2 Pyrimidinones as Casein Kinase II (CK2) modulators EXELIXIS, INC. (US) 2012-01-24 US claimed
EP-1948617-B1 PYRIMIDINONES AS CASEIN KINASE II (CK2) MODULATORS EXELIXIS INC (US) 2011-07-27 EP claimed
US-20090215803-A1 Pyrimidinones as Casein Kinase II (CK2) Modulators EXELIXIS, INC. 2009-08-27 US claimed
US-8101625-B2 Pyrimidinones as Casein Kinase II (CK2) modulators EXELIXIS, INC. (US) 2012-01-24 US disclosed
US-8101625-B2 Pyrimidinones as Casein Kinase II (CK2) modulators EXELIXIS, INC. (US) 2012-01-24 US disclosed
US-8101625-B2 Pyrimidinones as Casein Kinase II (CK2) modulators EXELIXIS, INC. (US) 2012-01-24 US disclosed
EP-1948617-B1 PYRIMIDINONES AS CASEIN KINASE II (CK2) MODULATORS EXELIXIS INC (US) 2011-07-27 EP disclosed
EP-1948617-B1 PYRIMIDINONES AS CASEIN KINASE II (CK2) MODULATORS EXELIXIS INC (US) 2011-07-27 EP disclosed
US-20090215803-A1 Pyrimidinones as Casein Kinase II (CK2) Modulators EXELIXIS, INC. 2009-08-27 US disclosed
US-20090215803-A1 Pyrimidinones as Casein Kinase II (CK2) Modulators EXELIXIS, INC. 2009-08-27 US disclosed
US-20090215803-A1 Pyrimidinones as Casein Kinase II (CK2) Modulators EXELIXIS, INC. 2009-08-27 US disclosed
WO-2007048065-A2 PYRIMIDINONES AS CASEIN KINASE II (CK2) MODULATORS EXELIXIS, INC. (US) 2007-04-26 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-20090215803-A1 Pyrimidinones as Casein Kinase II (CK2) Modulators CSNK2A1, CSNK1A1, CSNK2A2 CXCL12 2101/4885CDC7 536/4885PIM1 429/4885

“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.