SCHEMBL3545336

SCHEMBL3545336

CCN1CCC(NC(=O)c2cc(OC)c(Nc3ncc4c(n3)N(C3CCCC3)CCC(=O)N4C)cc2Cl)CC1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 13/20 0.68
RAD52 P43351 1/20 0.66
BRD4 O60885 3/20 0.58
BRDT Q58F21 3/20 0.58
TTK P33981 3/20 0.56
ALK Q9UM73 1/20 0.54
PLK3 Q9H4B4 2/20 0.54
PLK4 O00444 1/20 0.53
GAK O14976 1/20 0.53
STK33 Q9BYT3 1/20 0.53
PTK2 Q05397 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
SCHEMBL3544006 0.93 PLK1 (0.78) PLK1RAD52BRD4BRDTTTK
SCHEMBL3549242 0.91 PLK1 (0.68) PLK1RAD52BRD4BRDTTTK
SCHEMBL3547775 0.90 PLK1 (0.73) PLK1RAD52BRD4BRDTTTK
SCHEMBL3540521 0.89 PLK1 (0.66) PLK1RAD52BRD4BRDTTTK
SCHEMBL1202797 0.88 PLK1 (0.86) PLK1RAD52BRD4BRDTTTK
SCHEMBL3546059 0.87 RAD52 (0.87) PLK1RAD52BRD4BRDTTTK
SCHEMBL3542655 0.87 PLK1 (0.58) PLK1RAD52BRD4BRDTTTK
SCHEMBL3548404 0.86 PLK1 (0.65) PLK1RAD52BRD4BRDTTTK
SCHEMBL3542533 0.85 PLK1 (0.71) PLK1RAD52BRD4BRDTTTK
SCHEMBL3548112 0.84 RAD52 (0.60) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7709471-B2 Compounds ASTRAZENECA AB (SE) 2010-05-04 US 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.