SCHEMBL1288684

SCHEMBL1288684

CC[C@@H]1c2nnc(C)n2-c2cnc(-c3ccncc3)nc2N1C1CCC1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 18/20 0.47
BRD4 O60885 9/20 0.47
PLK2 Q9NYY3 10/20 0.41
PLK3 Q9H4B4 8/20 0.41
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
HIF1A Q16665 1/20 0.35

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
SCHEMBL1288688 1.00 PLK1 (0.47) PLK1BRD4PLK2PLK3ALDH1A1
SCHEMBL1288868 0.98 PLK1 (0.49) PLK1BRD4PLK2PLK3ALDH1A1
SCHEMBL1288866 0.98 PLK1 (0.49) PLK1BRD4PLK2PLK3ALDH1A1
SCHEMBL1288523 0.90 PLK1 (0.49) PLK1BRD4PLK2PLK3
SCHEMBL1288522 0.90 PLK1 (0.49) PLK1BRD4PLK2PLK3
SCHEMBL1288519 0.88 PLK1 (0.47) PLK1BRD4PLK2PLK3
SCHEMBL1288516 0.88 PLK1 (0.47) PLK1BRD4PLK2PLK3
SCHEMBL1288746 0.88 PLK1 (0.48) PLK1BRD4PLK2PLK3
SCHEMBL1288741 0.88 PLK1 (0.48) PLK1BRD4PLK2PLK3
SCHEMBL1288520 0.87 PLK1 (0.42) PLK1BRD4PLK2PLK3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2661268-A2 INHIBITORS OF POLO-LIKE KINASE Elan Pharmaceuticals Inc. (US) 2013-11-13 EP disclosed
US-20120115848-A1 Inhibitors of Polo-Like Kinase ELAN PHARMACEUTICALS, INC. (US) 2012-05-10 US disclosed
US-20120115848-A1 Inhibitors of Polo-Like Kinase ELAN PHARMACEUTICALS, INC. (US) 2012-05-10 US disclosed
US-20120115848-A1 Inhibitors of Polo-Like Kinase ELAN PHARMACEUTICALS, INC. (US) 2012-05-10 US disclosed
WO-2012048129-A2 INHIBITORS OF POLO-LIKE KINASE ELAN PHARMACEUTICALS, INC. (US) 2012-04-12 WO disclosed
WO-2012048129-A2 INHIBITORS OF POLO-LIKE KINASE ELAN PHARMACEUTICALS, INC. (US) 2012-04-12 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-20120115848-A1 Inhibitors of Polo-Like Kinase PLK1, POLR2E, POLR2H PLK1 1/4885BRD4 1149/4885PLK2 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.