SCHEMBL2032200

SCHEMBL2032200

CCC1C(=O)N(C)c2cnc(NN)nc2N1C1CCCC1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 19/20 0.69
PLK2 Q9NYY3 15/20 0.69
PLK3 Q9H4B4 15/20 0.69
BRD4 O60885 4/20 0.60
TAF1 P21675 1/20 0.60
ALK Q9UM73 1/20 0.59
PRKD3 O94806 1/20 0.57
MAP4K4 O95819 1/20 0.57
PRKCG P05129 1/20 0.57
CLK2 P49760 1/20 0.57
RPS6KA3 P51812 1/20 0.57
NEK4 P51957 1/20 0.57
PTK2 Q05397 1/20 0.57
CAMK2G Q13555 1/20 0.57
CAMK2D Q13557 1/20 0.57
SRPK1 Q96SB4 1/20 0.57
PRKD2 Q9BZL6 1/20 0.57
CSNK1G1 Q9HCP0 1/20 0.57
CSNK1G3 Q9Y6M4 1/20 0.57

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
SCHEMBL2032197 1.00 PLK1 (0.69) PLK1PLK2PLK3BRD4TAF1
SCHEMBL761490 0.86 PLK1 (0.61) PLK1PLK2PLK3BRD4TAF1
SCHEMBL27376920 0.86 PLK1 (0.64) PLK1PLK2PLK3BRD4TAF1
SCHEMBL25785687 0.86 PLK1 (0.80) PLK1PLK2PLK3BRD4TAF1
SCHEMBL13551775 0.85 PLK1 (0.82) PLK1PLK2PLK3BRD4TAF1
SCHEMBL27369473 0.85 PLK1 (0.82) PLK1PLK2PLK3BRD4TAF1
SCHEMBL17884568 0.85 PLK1 (0.62) PLK1PLK2PLK3BRD4TAF1
SCHEMBL1828713 0.84 PLK1 (0.60) PLK1PLK2PLK3BRD4TAF1
SCHEMBL1395135 0.84 PLK1 (0.60) PLK1PLK2PLK3BRD4TAF1
SCHEMBL1395138 0.84 PLK1 (0.60) PLK1PLK2PLK3BRD4TAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109503586-B Dihydropteridinone BRD4 protein inhibitor, preparation method and application thereof 郑州大学 2021-05-07 CN disclosed
US-20150126502-A1 INHIBITORS OF POLO-LIKE KINASE ELAN PHARM INC (US) 2015-05-07 US disclosed
EP-2516441-B1 PTERIDINONES AS INHIBITORS OF POLO-LIKE KINASE ELAN PHARM INC (US) 2015-01-21 EP disclosed
US-20130331376-A1 INHIBITORS OF POLO-LIKE KINASE Elan Corporation, Inc. (US) 2013-12-12 US disclosed
US-8541418-B2 Inhibitors of polo-like kinase ELAN PHARMACEUTICAL, INC. (US) 2013-09-24 US disclosed
US-20130231335-A1 INHIBITORS OF POLO-LIKE KINASE ELAN PHARMACEUTICALS, INC. (US) 2013-09-05 US disclosed
US-8445503-B2 Inhibitors of polo-like kinase ELAN PHARMACEUTICALS, INC. (US) 2013-05-21 US disclosed
EP-2516441-A1 PTERIDINONES AS INHIBITORS OF POLO-LIKE KINASE Elan Pharmaceuticals Inc. (US) 2012-10-31 EP disclosed
US-20110212942-A1 INHIBITORS OF POLO-LIKE KINASE ELAN PHARMACEUTICALS, INC. 2011-09-01 US disclosed
US-20110207716-A1 INHIBITORS OF POLO-LIKE KINASE ELAN PHARMACEUTICALS, INC. 2011-08-25 US disclosed
WO-2011079114-A1 PTERIDINONES AS INHIBITORS OF POLO - LIKE KINASE ELAN PHARMACEUTICALS, INC. (US) 2011-06-30 WO disclosed
WO-2011079118-A1 PTERIDINONES AS INHIBITORS OF POLO-LIKE KINASE ELAN PHARMACEUTICALS, INC (US) 2011-06-30 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 (5 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-20110212942-A1 INHIBITORS OF POLO-LIKE KINASE PLK1, POLK, POLR2E PLK1 1/4885PLK2 23/4885PLK3 92/4885
US-20130331376-A1 INHIBITORS OF POLO-LIKE KINASE PLK1, POLK, POLR2E PLK1 1/4885PLK2 22/4885PLK3 101/4885
US-20130231335-A1 INHIBITORS OF POLO-LIKE KINASE POLK, PLK1, POLR2E PLK1 2/4885PLK2 18/4885PLK3 76/4885
US-20110207716-A1 INHIBITORS OF POLO-LIKE KINASE PLK1, POLK, POLR2E PLK1 1/4885PLK2 22/4885PLK3 101/4885
US-20150126502-A1 INHIBITORS OF POLO-LIKE KINASE POLK, PLK1, POLR2E PLK1 2/4885PLK2 18/4885PLK3 76/4885

“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.