SCHEMBL3329115

SCHEMBL3329115

Cc1cc(-c2cc(-c3ccc(C(=O)N4CCCC(CN)C4)cc3)[nH]c(=O)n2)ccc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.52
CDC7 O00311 2/20 0.52
CSNK2A2 P19784 2/20 0.52
CSNK2A1 P68400 2/20 0.52
CLK1 P49759 1/20 0.52
GSK3B P49841 1/20 0.52
CSNK2B P67870 1/20 0.52
CSNK2A3 Q8NEV1 1/20 0.52
KDM1A O60341 1/20 0.39
CXCL12 P48061 1/20 0.39
FLT3 P36888 1/20 0.39
MAP3K12 Q12852 1/20 0.38
RIPK1 Q13546 2/20 0.37
PDGFRB P09619 1/20 0.36
KDR P35968 1/20 0.36
CHEK2 O96017 1/20 0.36
GRM3 Q14832 3/20 0.35
BRD4 O60885 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35

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
SCHEMBL3329261 0.93 PIM1 (0.52) PIM1CDC7CSNK2A2CSNK2A1CLK1
SCHEMBL3329048 0.90 PIM1 (0.56) PIM1CDC7CSNK2A2CSNK2A1CLK1
SCHEMBL3331425 0.88 PIM1 (0.56) PIM1CDC7CSNK2A2CSNK2A1CLK1
SCHEMBL3329671 0.86 PIM1 (0.48) PIM1CDC7CSNK2A2CSNK2A1CLK1
SCHEMBL3331937 0.86 PIM1 (0.51) PIM1CDC7CSNK2A2CSNK2A1CLK1
SCHEMBL3329226 0.85 PIM1 (0.65) PIM1CDC7CSNK2A2CSNK2A1CLK1
SCHEMBL3329917 0.85 PIM1 (0.64) PIM1CDC7CSNK2A2CSNK2A1CLK1
SCHEMBL3328230 0.85 PIM1 (0.64) PIM1CDC7CSNK2A2CSNK2A1CLK1
SCHEMBL3333305 0.83 PIM1 (0.57) PIM1CDC7CSNK2A2CSNK2A1CLK1
SCHEMBL3335290 0.82 PIM1 (0.48) PIM1CDC7CSNK2A2CSNK2A1CLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242129-B2 6-phenylpyrimidinones as PIM modulators EXELIXIS, INC. (US) 2012-08-14 US claimed
US-20100135954-A1 6-Phenylpyrimidinones as PIM Modulators EXELIXIS, INC. (US) 2010-06-03 US claimed
EP-2074103-A1 6-PHENYLPYRIMIDINONES AS PIM MODULATORS Exelixis, Inc. (US) 2009-07-01 EP claimed
WO-2008133955-A1 6-PHENYLPYRIMIDINONES AS PIM MODULATORS EXELIXIS, INC. (US) 2008-11-06 WO claimed
US-8242129-B2 6-phenylpyrimidinones as PIM modulators EXELIXIS, INC. (US) 2012-08-14 US disclosed
US-8242129-B2 6-phenylpyrimidinones as PIM modulators EXELIXIS, INC. (US) 2012-08-14 US disclosed
US-8242129-B2 6-phenylpyrimidinones as PIM modulators EXELIXIS, INC. (US) 2012-08-14 US disclosed
US-20100135954-A1 6-Phenylpyrimidinones as PIM Modulators EXELIXIS, INC. (US) 2010-06-03 US disclosed
US-20100135954-A1 6-Phenylpyrimidinones as PIM Modulators EXELIXIS, INC. (US) 2010-06-03 US disclosed
US-20100135954-A1 6-Phenylpyrimidinones as PIM Modulators EXELIXIS, INC. (US) 2010-06-03 US disclosed
EP-2074103-A1 6-PHENYLPYRIMIDINONES AS PIM MODULATORS Exelixis, Inc. (US) 2009-07-01 EP disclosed
WO-2008133955-A1 6-PHENYLPYRIMIDINONES AS PIM MODULATORS EXELIXIS, INC. (US) 2008-11-06 WO disclosed
WO-2008133955-A1 6-PHENYLPYRIMIDINONES AS PIM MODULATORS EXELIXIS, INC. (US) 2008-11-06 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-20100135954-A1 6-Phenylpyrimidinones as PIM Modulators PIM1, PIM2, PIM3 PIM1 1/4885CDC7 3813/4885CSNK2A2 61/4885

“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.