SCHEMBL4909244

SCHEMBL4909244

Cc1[nH]c(C(=O)Nc2ccc(-c3cnc(N4CCOCC4)c(C(=O)O)c3)cc2)c(Cl)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 1/20 0.48
MAPT P10636 3/20 0.43
ALDH1A1 P00352 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CNR2 P34972 2/20 0.43
DGAT1 O75907 2/20 0.42
MAOB P27338 1/20 0.42
CNR1 P21554 1/20 0.41
MTOR P42345 2/20 0.40

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
SCHEMBL4904742 0.91 MAPT (0.43) TOP2AMAPTALDH1A1RAB9ASMN1; SMN2
SCHEMBL4908310 0.83 NR3C1 (0.42) TOP2ASMN1; SMN2CNR1
SCHEMBL4901768 0.82 DAO (0.46) TOP2A
SCHEMBL4907614 0.79 TOP2A (0.42) TOP2A
SCHEMBL4910399 0.77 CD274 (0.42) ALDH1A1
SCHEMBL4904828 0.76 DAO (0.41) TOP2A
SCHEMBL3264683 0.75 CNR2 (0.49) SMN1; SMN2CNR2CNR1
SCHEMBL4907263 0.75 IKBKE (0.44) TOP2AMAPTSMN1; SMN2
SCHEMBL4909671 0.74 DAO (0.39) TOP2A
SCHEMBL4908508 0.74 DAO (0.48) 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 4 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

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 2/4885MAPT 2515/4885ALDH1A1 2262/4885

“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.