SCHEMBL2344516

SCHEMBL2344516

CCC12CCCN1c1nc(-n3ccnc3)ncc1N(C)C2=O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLK2 Q9NYY3 12/20 0.35
PLK1 P53350 10/20 0.35
PLK3 Q9H4B4 1/20 0.33
CD38 P28907 2/20 0.32
SIGMAR1 Q99720 1/20 0.31
NOS2 P35228 1/20 0.30

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
SCHEMBL2344507 1.00 PLK2 (0.35) PLK2PLK1PLK3CD38SIGMAR1
SCHEMBL2053287 0.97 PLK2 (0.35) PLK2PLK1PLK3CD38SIGMAR1
SCHEMBL6844666 0.97 PLK2 (0.35) PLK2PLK1PLK3CD38SIGMAR1
SCHEMBL2053288 0.97 PLK2 (0.35) PLK2PLK1PLK3CD38SIGMAR1
SCHEMBL2342072 0.89 PLK2 (0.35) PLK2PLK1CD38NOS2
SCHEMBL2049947 0.82 PLK2 (0.33) PLK2PLK1PLK3CD38
SCHEMBL2049945 0.82 PLK2 (0.33) PLK2PLK1PLK3CD38
SCHEMBL2689396 0.80 SIGMAR1 (0.32) SIGMAR1
SCHEMBL2048583 0.80 PLK2 (0.51) PLK2PLK1PLK3
SCHEMBL2048588 0.80 PLK2 (0.51) PLK2PLK1PLK3

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
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-20110207716-A1 INHIBITORS OF POLO-LIKE KINASE ELAN PHARMACEUTICALS, INC. 2011-08-25 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 (2 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-20130331376-A1 INHIBITORS OF POLO-LIKE KINASE PLK1, POLK, POLR2E PLK2 22/4885PLK1 1/4885PLK3 101/4885
US-20110207716-A1 INHIBITORS OF POLO-LIKE KINASE PLK1, POLK, POLR2E PLK2 22/4885PLK1 1/4885PLK3 101/4885

“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.