SCHEMBL2689720

SCHEMBL2689720

CCC1c2nncn2-c2cnc(Cl)nc2N1[C@@H]1CCOC1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 11/20 0.47
PLK1 P53350 15/20 0.42
PLK2 Q9NYY3 6/20 0.42
PRKDC P78527 3/20 0.32

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
SCHEMBL2689719 1.00 BRD4 (0.47) BRD4PLK1PLK2PRKDC
SCHEMBL5928523 1.00 BRD4 (0.47) BRD4PLK1PLK2PRKDC
SCHEMBL2689723 1.00 BRD4 (0.47) BRD4PLK1PLK2PRKDC
SCHEMBL1288295 0.94 BRD4 (0.51) BRD4PLK1PLK2PRKDC
SCHEMBL1288293 0.94 BRD4 (0.51) BRD4PLK1PLK2PRKDC
SCHEMBL1288651 0.88 BRD4 (0.55) BRD4PLK1PLK2
SCHEMBL1288648 0.88 BRD4 (0.55) BRD4PLK1PLK2
SCHEMBL1288485 0.86 BRD4 (0.58) BRD4PLK1PLK2
SCHEMBL1288479 0.86 BRD4 (0.58) BRD4PLK1PLK2
SCHEMBL383800 0.86 BRD4 (0.60) BRD4PLK1PLK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120115848-A1 Inhibitors of Polo-Like Kinase ELAN PHARMACEUTICALS, INC. (US) 2012-05-10 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-20120115848-A1 Inhibitors of Polo-Like Kinase PLK1, POLR2E, POLR2H BRD4 1149/4885PLK1 1/4885PLK2 19/4885

“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.