SCHEMBL4909723

SCHEMBL4909723

Cc1[nH]c(C(=O)Nc2ccc(-c3cc(C(=O)O)ccn3)cc2)c(Cl)c1Cl

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 1/20 0.49
KMO O15229 1/20 0.48
KDM5A P29375 3/20 0.48
KDM4D Q6B0I6 3/20 0.48
KDM4C Q9H3R0 3/20 0.48
KDM5B Q9UGL1 3/20 0.48
KDM3A Q9Y4C1 3/20 0.48
KDM6B O15054 2/20 0.48
KDM2A Q9Y2K7 2/20 0.48
HIF1AN Q9NWT6 1/20 0.48
SMO Q99835 2/20 0.45

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
SCHEMBL4909641 0.89 KDM4E (0.47) TOP2AKDM4CKDM3AKDM6BKDM2A
SCHEMBL29717252 0.81 TOP2A (0.56) TOP2A
SCHEMBL4903739 0.79 SCN10A (0.51) SMO
SCHEMBL4908579 0.78 KMO (0.48) KMO
SCHEMBL4901768 0.76 DAO (0.46) TOP2A
SCHEMBL4912668 0.76 DAO (0.46) TOP2A
SCHEMBL4909699 0.76 OGT (0.52)
SCHEMBL5263131 0.75 HPGD (0.52)
SCHEMBL5266303 0.73 DAO (0.45)
SCHEMBL4907614 0.73 TOP2A (0.42) TOP2A

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 TOP2A 2/4885KMO 2107/4885KDM5A 1223/4885

“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.