SCHEMBL4907263

SCHEMBL4907263

COC(=O)c1cc(-c2ccc(NC(=O)c3[nH]c(C)c(Cl)c3Cl)cc2)cnc1Cl

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IKBKE Q14164 1/20 0.44
TBK1 Q9UHD2 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
DAO P14920 1/20 0.42
TOP2A P11388 2/20 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
SCHEMBL4906966 0.90 IKBKE (0.42) IKBKETBK1KDM4EMEN1LMNA
SCHEMBL4901768 0.89 DAO (0.46) DAOTOP2A
SCHEMBL4909354 0.89 CHRNA7 (0.42) IKBKETBK1KDM4EMEN1LMNA
SCHEMBL4907603 0.85 IKBKE (0.39) IKBKETBK1KDM4EMEN1LMNA
SCHEMBL4907614 0.84 TOP2A (0.42) DAOTOP2A
SCHEMBL4904742 0.83 MAPT (0.43) KDM4EMEN1LMNAMAPTKMT2A
SCHEMBL4909855 0.82 IKBKE (0.37) IKBKETBK1TOP2A
SCHEMBL4903831 0.81 DAO (0.39) DAOTOP2A
SCHEMBL4900067 0.81 DAO (0.44) KDM4EMEN1LMNAMAPTKMT2A
SCHEMBL4909851 0.80 HDAC6 (0.41) KDM4EMEN1LMNAMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080269214-A1 Pyrrole Derivatives as Dna Gyrase and Topoisomerase Inhibitors ASTRAZENECA AB (SE) 2008-10-30 US claimed
EP-1861393-A2 PYRROLE DERIVATIVES AS DNA GYRASE AND TOPOISOMERASE INHIBITORS AstraZeneca AB (SE) 2007-12-05 EP claimed
WO-2006092599-A2 PYRROLE DERIVATIVES AS DNA GYRASE AND TOPOISOMERASE INHIBITORS ASTRAZENECA AB (SE) 2006-09-08 WO claimed
US-20080269214-A1 Pyrrole Derivatives as Dna Gyrase and Topoisomerase Inhibitors ASTRAZENECA AB (SE) 2008-10-30 US disclosed
EP-1861393-A2 PYRROLE DERIVATIVES AS DNA GYRASE AND TOPOISOMERASE INHIBITORS AstraZeneca AB (SE) 2007-12-05 EP disclosed
WO-2006092599-A2 PYRROLE DERIVATIVES AS DNA GYRASE AND TOPOISOMERASE INHIBITORS ASTRAZENECA AB (SE) 2006-09-08 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-20080269214-A1 Pyrrole Derivatives as Dna Gyrase and Topoisomerase Inhibitors TOP1, TOP2A, TOP2B IKBKE 1220/4885TBK1 514/4885KDM4E 1366/4885

“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.