SCHEMBL3545348

SCHEMBL3545348

CC(C)N1CC(C)(C)C(=O)N(C)c2cnc(Nc3cc(F)c(C(=O)NC4CCC(N(C)C)CC4)cc3Cl)nc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 14/20 0.50
PLK3 Q9H4B4 6/20 0.46
PLK2 Q9NYY3 6/20 0.46
LRRK2 Q5S007 4/20 0.42
CHEK1 O14757 1/20 0.41
IKBKB O14920 1/20 0.41
AURKA O14965 1/20 0.41
MAP4K4 O95819 1/20 0.41
PAK4 O96013 1/20 0.41
CHEK2 O96017 1/20 0.41
ABL1 P00519 1/20 0.41
EGFR P00533 1/20 0.41
INSR P06213 1/20 0.41
LCK P06239 1/20 0.41
FGFR1 P11362 1/20 0.41
SELP P16109 1/20 0.41
CSNK2A2 P19784 1/20 0.41
CCNA2 P20248 1/20 0.41
CDK2 P24941 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL3540805 0.91 PLK1 (0.60) PLK1PLK3PLK2LRRK2BRD4
SCHEMBL3544823 0.88 PLK1 (0.61) PLK1PLK3PLK2BRD4BRDT
SCHEMBL3541574 0.88 PLK1 (0.53) PLK1PLK3PLK2LRRK2BRD4
SCHEMBL3545836 0.83 PLK1 (0.60) PLK1PLK3PLK2BRD4BRDT
SCHEMBL3540861 0.82 PLK1 (0.59) PLK1PLK3PLK2BRD4BRDT
SCHEMBL3545591 0.82 PLK1 (0.52) PLK1PLK3PLK2LRRK2BRD4
SCHEMBL3541132 0.81 PLK1 (0.56) PLK1PLK3PLK2LRRK2BRD4
SCHEMBL3541137 0.81 PLK1 (0.56) PLK1PLK3PLK2LRRK2BRD4
SCHEMBL3544305 0.81 PLK1 (0.74) PLK1PLK3PLK2BRD4BRDT
SCHEMBL3549663 0.80 PLK1 (0.55) PLK1PLK3PLK2MAP4K4BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7709471-B2 Compounds ASTRAZENECA AB (SE) 2010-05-04 US disclosed
US-20080009482-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2008-01-10 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-20080009482-A1 NOVEL COMPOUNDS CYP11B2, CYP11B1, CYP46A1 PLK1 847/4885PLK3 2136/4885PLK2 1286/4885

“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.