SCHEMBL3987399

SCHEMBL3987399

CN1CCC(NC(=O)c2ccc(Nc3ncc4c(n3)N(C3CCCC3)CCC(=O)N4C)nc2)CC1

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 14/20 0.74
RAD52 P43351 1/20 0.73
TTK P33981 1/20 0.64
BRD4 O60885 7/20 0.64
BRDT Q58F21 5/20 0.64
ALK Q9UM73 1/20 0.62
TAF1 P21675 2/20 0.58
PLK3 Q9H4B4 1/20 0.54

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
SCHEMBL13846150 0.92 PLK1 (0.64) PLK1RAD52TTKBRD4BRDT
SCHEMBL1203323 0.90 PLK1 (0.76) PLK1RAD52TTKBRD4BRDT
SCHEMBL21755686 0.88 BRD4 (0.64) PLK1RAD52TTKBRD4BRDT
SCHEMBL3988414 0.87 PLK1 (0.83) PLK1RAD52BRD4BRDTALK
SCHEMBL1202827 0.87 PLK1 (0.83) PLK1RAD52BRD4BRDTALK
SCHEMBL4104990 0.87 PLK1 (0.70) PLK1RAD52TTKBRD4BRDT
SCHEMBL1204198 0.86 PLK1 (0.82) PLK1RAD52BRD4BRDTALK
SCHEMBL1204350 0.86 PLK1 (0.82) PLK1RAD52BRD4BRDTALK
SCHEMBL1203489 0.86 PLK1 (0.70) PLK1RAD52TTKBRD4BRDT
SCHEMBL1203973 0.86 PLK1 (0.75) PLK1RAD52BRD4BRDTALK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090291938-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-26 US claimed
WO-2009067547-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-28 WO claimed
US-20090291938-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-26 US disclosed
US-20090291938-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-26 US disclosed
US-20090291938-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-26 US disclosed
WO-2009067547-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-28 WO disclosed
WO-2009067547-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-28 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-20090291938-A1 POLO-LIKE KINASE INHIBITORS PLK1, PLK2, POLK PLK1 1/4885RAD52 1250/4885TTK 171/4885

“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.