SCHEMBL4296398

SCHEMBL4296398

CC(=O)N1c2ccccc2NC2=C(C(=O)CC(C)(C)C2)C1c1ccc(OCc2ccccc2)cc1OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.59
KMT2A Q03164 1/20 0.59
KDM4E B2RXH2 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 3/20 0.46
MAPT P10636 2/20 0.46
SIRT1 Q96EB6 4/20 0.42
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42

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
SCHEMBL13704094 0.92 MEN1 (0.57) MEN1KMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL13704056 0.92 MEN1 (0.57) MEN1KMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL13704098 0.92 MEN1 (0.57) MEN1KMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL4289956 0.89 MEN1 (0.63) MEN1KMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL13704097 0.88 MEN1 (0.63) MEN1KMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL13704095 0.88 MEN1 (0.63) MEN1KMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL13704096 0.88 MEN1 (0.63) MEN1KMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL4288741 0.85 MEN1 (0.57) MEN1KMT2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL13704066 0.83 MEN1 (0.72) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL4294419 0.83 MEN1 (0.62) MEN1KMT2AKDM4ESMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090221559-A1 BENZODIAZEPINES AS HCV INHIBITORS BONFANTI JEAN-FRANCOIS 2009-09-03 US disclosed
US-20090221559-A1 BENZODIAZEPINES AS HCV INHIBITORS BONFANTI JEAN-FRANCOIS 2009-09-03 US disclosed
WO-2007026024-A2 BENZODIAZEPINES AS HCV INHIBITORS TIBOTEC PHARMACEUTICALS LTD. (IE) 2007-03-08 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-20090221559-A1 BENZODIAZEPINES AS HCV INHIBITORS GABRA5, GABRA4, GABRA3 MEN1 4829/4885KMT2A 1440/4885KDM4E 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.