SCHEMBL6090192

SCHEMBL6090192

O=C1CCN2c3c1cccc3C(=O)NC2c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
KDM4E B2RXH2 3/20 0.46
GAA P10253 3/20 0.46
MEN1 O00255 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 2/20 0.41
GPR174 Q9BXC1 1/20 0.37
HTR7 P34969 1/20 0.37
MAPT P10636 2/20 0.36
HTR1A P08908 1/20 0.35
DRD1 P21728 1/20 0.35
SCN2A Q99250 1/20 0.35
LMNA P02545 2/20 0.34
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
RECQL P46063 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL6089474 0.86 KDM4E (0.44) KMT2AKDM4EGAAMEN1SMN1; SMN2
SCHEMBL6089473 0.86 KDM4E (0.44) KMT2AKDM4EGAAMEN1SMN1; SMN2
SCHEMBL6090523 0.84 TNKS2 (0.39) KMT2AKDM4EMEN1ALDH1A1MAPT
SCHEMBL6090917 0.83 MEN1 (0.40) KMT2AKDM4EGAAMEN1SMN1; SMN2
SCHEMBL6090911 0.83 MEN1 (0.40) KMT2AKDM4EGAAMEN1SMN1; SMN2
SCHEMBL6089480 0.83 TNKS2 (0.42) KMT2AKDM4EGAAMEN1SMN1; SMN2
SCHEMBL6089877 0.83 PARP1 (0.39) KMT2AKDM4EMEN1SMN1; SMN2ALDH1A1
SCHEMBL6091873 0.83 MEN1 (0.42) KMT2AKDM4EGAAMEN1SMN1; SMN2
SCHEMBL6089743 0.80 LMNA (0.44) KMT2AKDM4EGAAMEN1SMN1; SMN2
SCHEMBL6089948 0.80 KDM4E (0.42) KMT2AKDM4EGAAMEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060004028-A1 Novel PARP inhibitor MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2006-01-05 US disclosed
EP-1582520-A1 NOVEL PARP INHIBITORS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2005-10-05 EP 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-20060004028-A1 Novel PARP inhibitor PARP1, PARP2, PARP11 KMT2A 274/4885KDM4E 812/4885GAA 2522/4885

“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.