SCHEMBL4122466

SCHEMBL4122466

COc1cc(C(=O)NN2CCN(C3CCCC3)CC2)ccc1Nc1ncc2c(n1)N(c1ccccc1)CC(C)(C)C(=O)N2C

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 15/20 0.62
BRD4 O60885 9/20 0.55
BRDT Q58F21 8/20 0.55
LRRK2 Q5S007 3/20 0.53
MAPK7 Q13164 2/20 0.53
DCLK1 O15075 1/20 0.51
PLK3 Q9H4B4 1/20 0.50
PLK2 Q9NYY3 1/20 0.50
RAD52 P43351 1/20 0.50

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
SCHEMBL1675594 0.93 PLK1 (0.65) PLK1BRD4BRDTLRRK2MAPK7
SCHEMBL3992576 0.92 PLK1 (0.62) PLK1BRD4BRDTLRRK2MAPK7
SCHEMBL4122461 0.89 PLK1 (0.72) PLK1BRD4BRDTPLK3RAD52
SCHEMBL2394146 0.86 PTK2 (0.56) PLK1BRD4BRDTLRRK2MAPK7
SCHEMBL3994195 0.85 BRD4 (0.52) PLK1BRD4BRDTLRRK2MAPK7
SCHEMBL1203353 0.85 PLK1 (0.80) PLK1BRD4BRDTPLK3RAD52
SCHEMBL1675893 0.85 PLK1 (0.60) PLK1BRD4BRDTLRRK2MAPK7
SCHEMBL2398985 0.85 PLK1 (0.73) PLK1BRD4BRDTPLK3PLK2
SCHEMBL1675878 0.84 PLK1 (0.65) PLK1BRD4BRDTLRRK2MAPK7
SCHEMBL4107624 0.84 BRD4 (0.68) PLK1BRD4BRDTLRRK2MAPK7

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-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
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 1/4885BRD4 1323/4885BRDT 579/4885

“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.