SCHEMBL4073223

SCHEMBL4073223

COc1ccc2ncc(Cl)c(N3CCC(CCNC(=O)OC(C)(C)C)CC3)c2n1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SUV39H2 Q9H5I1 5/20 0.48
SIRT2 Q8IXJ6 1/20 0.45
SIRT1 Q96EB6 1/20 0.45
SIRT3 Q9NTG7 1/20 0.45
CKS1B P61024 1/20 0.42
SKP1 P63208 1/20 0.42
SKP2 Q13309 1/20 0.42
MELK Q14680 2/20 0.40
STK17B O94768 1/20 0.39
STK17A Q9UEE5 1/20 0.39
KCNH2 Q12809 1/20 0.38
ACACB O00763 3/20 0.38
ACACA Q13085 3/20 0.38
CHRM4 P08173 3/20 0.38
DRD2 P14416 2/20 0.37
DYRK1A Q13627 1/20 0.36

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
SCHEMBL4069637 0.84 SIRT2 (0.47) SUV39H2SIRT2SIRT1SIRT3CKS1B
SCHEMBL4069719 0.83 SUV39H2 (0.48) SUV39H2SIRT2SIRT1SIRT3MELK
SCHEMBL5751891 0.80 ENPP1 (0.42) SUV39H2MELKKCNH2DYRK1A
SCHEMBL14169770 0.77 DRD2 (0.52) SUV39H2DRD2
SCHEMBL4073225 0.77 SUV39H2 (0.47) SUV39H2SIRT2SIRT1SIRT3CKS1B
SCHEMBL13238463 0.77 DRD2 (0.52) SUV39H2KCNH2DRD2
SCHEMBL17861460 0.75 CKS1B (0.48) SUV39H2CKS1BSKP1SKP2KCNH2
SCHEMBL4074224 0.74 KCNH2 (0.58) KCNH2
SCHEMBL1222880 0.74 CYP8B1 (0.48) SUV39H2CKS1BSKP1SKP2ACACB
SCHEMBL4068344 0.74 KCNH2 (0.42) KCNH2DRD2

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
EP-1605938-B1 Antibacterial derivatives of napthydrin and quinoline GLAXO GROUP LTD (GB) 2009-02-11 EP disclosed
EP-1605938-A4 ANTIBACTERIAL AGENTS GLAXO GROUP LTD (GB) 2006-11-22 EP disclosed
US-20060189601-A1 Antibacterial agents GLAXO GROUP LIMITED (GB) 2006-08-24 US disclosed
EP-1605938-A2 ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2005-12-21 EP disclosed
WO-2004087145-A2 ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2004-10-14 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-20060189601-A1 Antibacterial agents NQO2, NRDC, IFNG SUV39H2 3278/4885SIRT2 733/4885SIRT1 983/4885

“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.