SCHEMBL3544188

SCHEMBL3544188

COC(=O)c1ccc(Nc2ncc3c(n2)N(C2CCCC2)CCCN3C)c(OC)c1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 17/20 0.61
RAD52 P43351 1/20 0.60
BRD4 O60885 7/20 0.60
BRDT Q58F21 7/20 0.60
TTK P33981 2/20 0.56
PLK3 Q9H4B4 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
SCHEMBL3546310 0.93 PLK1 (0.63) PLK1RAD52BRD4BRDTTTK
SCHEMBL3539750 0.87 PLK1 (0.79) PLK1RAD52BRD4BRDTTTK
SCHEMBL4193051 0.83 PLK1 (0.63) PLK1BRD4BRDTTTKPLK3
SCHEMBL11890119 0.82 PLK1 (0.66) PLK1RAD52BRD4BRDTTTK
SCHEMBL4080141 0.82 PLK1 (0.67) PLK1RAD52BRD4BRDTPLK3
SCHEMBL30750496 0.82 PLK1 (0.62) PLK1BRD4BRDTTTKPLK3
SCHEMBL26814574 0.82 PLK1 (0.79) PLK1RAD52BRD4BRDTPLK3
SCHEMBL4109906 0.81 PLK1 (0.74) PLK1RAD52BRD4BRDTTTK
SCHEMBL1675704 0.81 PLK1 (0.58) PLK1RAD52BRD4BRDTTTK
SCHEMBL1203517 0.80 PLK1 (0.81) PLK1RAD52BRD4BRDTTTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7709471-B2 Compounds ASTRAZENECA AB (SE) 2010-05-04 US disclosed
EP-2046793-A2 FUSED PYRIMIDO COMPOUNDS AstraZeneca AB (SE) 2009-04-15 EP disclosed
WO-2008003958-A2 FUSED PYRIMIDO COMPOUNDS ASTRAZENECA AB (SE) 2008-01-10 WO disclosed
US-20080009482-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2008-01-10 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-20080009482-A1 NOVEL COMPOUNDS CYP11B2, CYP11B1, CYP46A1 PLK1 847/4885RAD52 4730/4885BRD4 2662/4885

“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.