SCHEMBL14734875

SCHEMBL14734875

C=CC1(F)CN(C2CCCC2)c2nc(Nc3c(OC)cc(C(=O)O)c(F)c3C)ncc2N(C)C1=O

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 18/20 0.61
BRD4 O60885 2/20 0.49
BRDT Q58F21 2/20 0.49
TTK P33981 2/20 0.41
RAD52 P43351 1/20 0.40

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
SCHEMBL14734877 1.00 PLK1 (0.61) PLK1BRD4BRDTTTKRAD52
SCHEMBL1675599 0.88 PLK1 (0.67) PLK1BRD4BRDTTTK
SCHEMBL1675595 0.88 PLK1 (0.67) PLK1BRD4BRDTTTK
SCHEMBL1675891 0.84 PLK1 (0.67) PLK1BRD4BRDTTTK
SCHEMBL1675890 0.84 PLK1 (0.67) PLK1BRD4BRDTTTK
SCHEMBL12301383 0.83 PLK1 (0.82) PLK1BRD4BRDTRAD52
SCHEMBL1675782 0.83 PLK1 (0.82) PLK1BRD4BRDTRAD52
SCHEMBL12301382 0.83 PLK1 (0.82) PLK1BRD4BRDTRAD52
SCHEMBL31405290 0.83 PLK1 (0.82) PLK1BRD4BRDTRAD52
SCHEMBL1675901 0.82 PLK1 (0.81) PLK1BRD4BRDTRAD52

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
EP-2205241-B1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2014-05-21 EP disclosed
EP-2564850-A1 Polo-like kinase inhibitors Takeda Pharmaceutical Company Limited (JP) 2013-03-06 EP disclosed