SCHEMBL4289896

SCHEMBL4289896

CC(=O)N1c2cc(C(=O)O)ccc2NC2=C(C(=O)CC(C)(C)C2)C1c1ccc(Cl)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.48
KMT2A Q03164 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 1/20 0.39
MCL1 Q07820 2/20 0.37
GSK3A P49840 1/20 0.37
GSK3B P49841 1/20 0.37

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
SCHEMBL4287067 0.93 MEN1 (0.48) MEN1KMT2ASMN1; SMN2KDM4EHSD17B10
SCHEMBL14582937 0.92 MEN1 (0.47) MEN1KMT2ASMN1; SMN2KDM4EALDH1A1
SCHEMBL4287200 0.91 MEN1 (0.50) MEN1KMT2ASMN1; SMN2KDM4EHSD17B10
SCHEMBL4291113 0.88 MEN1 (0.49) MEN1KMT2ASMN1; SMN2KDM4EHSD17B10
SCHEMBL4287691 0.87 MEN1 (0.62) MEN1KMT2ASMN1; SMN2KDM4EHSD17B10
SCHEMBL13704122 0.87 MEN1 (0.47) MEN1KMT2ASMN1; SMN2KDM4EHSD17B10
SCHEMBL4290980 0.86 MEN1 (0.48) MEN1KMT2ASMN1; SMN2KDM4EHSD17B10
SCHEMBL13704149 0.86 MEN1 (0.47) MEN1KMT2ASMN1; SMN2KDM4EHSD17B10
SCHEMBL4296680 0.86 MEN1 (0.47) MEN1KMT2ASMN1; SMN2HSD17B10ALDH1A1
SCHEMBL4300461 0.84 KMT2A (0.56) MEN1KMT2ASMN1; SMN2KDM4EHSD17B10

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
US-20090221559-A1 BENZODIAZEPINES AS HCV INHIBITORS BONFANTI JEAN-FRANCOIS 2009-09-03 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-20090221559-A1 BENZODIAZEPINES AS HCV INHIBITORS GABRA5, GABRA4, GABRA3 MEN1 4829/4885KMT2A 1440/4885SMN1; SMN2 4135/4885

“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.