SCHEMBL1925869

SCHEMBL1925869

CN1CCC(NC(=O)c2cccc(Nc3nccc(Nc4c(NC(C)(C)C)c(=O)c4=O)n3)c2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 12/20 0.56
CDK2 P24941 4/20 0.54
CCNT1 O60563 3/20 0.54
CCNA2 P20248 3/20 0.54
CDK9 P50750 3/20 0.54
IGF1R P08069 1/20 0.53
ROCK2 O75116 3/20 0.50
NTRK1 P04629 1/20 0.49
NTRK3 Q16288 1/20 0.49
NTRK2 Q16620 1/20 0.49
PLK4 O00444 2/20 0.49
CHEK1 O14757 2/20 0.49
PDPK1 O15530 2/20 0.49
CHEK2 O96017 2/20 0.49
CSF1R P07333 2/20 0.49
MET P08581 2/20 0.49
PIM1 P11309 2/20 0.49
FLT1 P17948 2/20 0.49
FGFR3 P22607 2/20 0.49
MARK3 P27448 2/20 0.49

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
SCHEMBL1927251 0.92 PLK1 (0.54) PLK1CDK2ROCK2PLK4CHEK1
SCHEMBL1926129 0.92 PLK1 (0.54) PLK1CDK2ROCK2PLK4CHEK1
SCHEMBL1926986 0.91 PLK1 (0.54) PLK1CDK2ROCK2PLK4CHEK1
SCHEMBL1926287 0.91 PLK1 (0.54) PLK1CDK2ROCK2PLK4CHEK1
SCHEMBL1927435 0.87 PLK1 (0.55) PLK1CDK2IGF1RROCK2PLK4
SCHEMBL1927350 0.83 NPC1 (0.69) PLK1CDK2ROCK2PLK4CHEK1
SCHEMBL1925685 0.82 PLK1 (0.56) PLK1IGF1RROCK2PLK4CHEK1
SCHEMBL1928386 0.78 PLK1 (0.53) PLK1CDK2ROCK2PLK4CHEK1
SCHEMBL1926075 0.77 PLK1 (0.64) PLK1ROCK2PLK4CHEK1PDPK1
SCHEMBL1927355 0.77 PLK1 (0.47) PLK1IGF1RROCK2PLK4CHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7956185-B2 Cyclobut-3-ene-1,2,-dione inhibitors of polo-like kinases ABBOTT LABORATORIES (US) 2011-06-07 US claimed
US-7956185-B2 Cyclobut-3-ene-1,2,-dione inhibitors of polo-like kinases ABBOTT LABORATORIES (US) 2011-06-07 US disclosed
EP-2021316-A1 INHIBITORS OF POLO-LIKE KINASES Abbott Laboratories (US) 2009-02-11 EP disclosed
US-20080015192-A1 INHIBITORS OF POLO-LIKE KINASES ABBVIE INC. 2008-01-17 US disclosed
WO-2007140233-A1 INHIBITORS OF POLO-LIKE KINASES ABBOTT LABORATORIES (US) 2007-12-06 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-20080015192-A1 INHIBITORS OF POLO-LIKE KINASES PLK1, PLK2, BUB1B PLK1 1/4885CDK2 30/4885CCNT1 617/4885

“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.