SCHEMBL6809882

SCHEMBL6809882

O=C(O)C1COC(c2nc(-c3ccc(F)cc3)c(-c3ccnc(NCc4cccnc4)n3)[nH]2)OC1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.55
MAPK13 O15264 9/20 0.55
MAPK12 P53778 9/20 0.55
MAPK11 Q15759 9/20 0.55
CDK2 P24941 2/20 0.43
CLK1 P49759 2/20 0.43
DYRK1A Q13627 2/20 0.43
CLK4 Q9HAZ1 2/20 0.43
CLK2 P49760 1/20 0.43
CLK3 P49761 1/20 0.43
DYRK1B Q9Y463 1/20 0.43

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
SCHEMBL6808766 0.91 MAPK14 (0.57) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5770734 0.89 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11CDK2
SCHEMBL6809410 0.88 MAPK14 (0.49) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5768827 0.87 MAPK14 (0.66) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5770149 0.87 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11CDK2
SCHEMBL7221075 0.87 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6809563 0.86 MAPK14 (0.69) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5771052 0.86 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11CDK2
SCHEMBL5771861 0.85 MAPK14 (0.65) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5770829 0.85 MAPK13 (0.63) MAPK14MAPK13MAPK12MAPK11

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-20040038991-A1 Imidazolyl-cyclic acetals AVENTIS PHARMA LIMITED (GB) 2004-02-26 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-20040038991-A1 Imidazolyl-cyclic acetals CBR1, LBR, CBR3 MAPK14 1915/4885MAPK13 1610/4885MAPK12 2766/4885

“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.