SCHEMBL14101194

SCHEMBL14101194

C=C(C)CN1c2nc(Nc3ccc(N)cc3OC)ncc2N(C)C(=O)[C@H]1C

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 13/20 0.50
▸ BRD4 O60885 13/20 0.50
▸ BRDT Q58F21 11/20 0.50
▸ VRK1 Q99986 3/20 0.47
▸ RPS6KA3 P51812 2/20 0.47
▸ PARP1 P09874 2/20 0.46
▸ PLK3 Q9H4B4 1/20 0.45
▸ PLK2 Q9NYY3 1/20 0.45

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
SCHEMBL13360849 0.87 BRD4 (0.49) PLK1BRD4BRDTVRK1RPS6KA3
SCHEMBL12956561 0.86 RPS6KA3 (0.62) PLK1BRD4BRDTVRK1RPS6KA3
SCHEMBL13104998 0.80 BRD4 (0.72) PLK1BRD4BRDTRPS6KA3PARP1
SCHEMBL13104981 0.77 RPS6KA3 (0.49) PLK1BRD4BRDTVRK1RPS6KA3
SCHEMBL12956560 0.76 PLK1 (0.69) PLK1BRD4BRDTRPS6KA3PLK3
SCHEMBL21527053 0.75 RPS6KA3 (0.62) PLK1BRD4BRDTVRK1RPS6KA3
SCHEMBL862198 0.75 RPS6KA3 (0.62) PLK1BRD4BRDTVRK1RPS6KA3
SCHEMBL13104992 0.74 PLK1 (0.76) PLK1BRD4BRDTRPS6KA3PLK3
SCHEMBL12957059 0.72 BRD4 (0.44) PLK1BRD4BRDT
SCHEMBL862111 0.71 PLK1 (0.77) PLK1BRD4BRDTRPS6KA3PLK3

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-20080194818-A1 Antiproliferative agents; polo-like kinase inhibitors GRAUERT MATTHIAS 2008-08-14 — — 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-20080194818-A1 Antiproliferative agents; polo-like kinase inhibitors CCNK, CDK1, PLK1 PLK1 3/4885BRD4 2309/4885BRDT 1291/4885

“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.

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