SCHEMBL1242385

SCHEMBL1242385

CC(C)Oc1ccc([N+](=O)[O-])c(-c2ccc(OC(F)(F)F)cc2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EIF4E P06730 1/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
MITF O75030 1/20 0.42
TXNRD1 Q16881 1/20 0.39
MAPT P10636 3/20 0.39
HTT P42858 3/20 0.39
TP53 P04637 1/20 0.39
CASP3 P42574 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
THRB P10828 1/20 0.37
PTGES O14684 1/20 0.37
PTGS2 P35354 1/20 0.37
PTPN5 P54829 1/20 0.36
HTR7 P34969 1/20 0.36
PDK1 Q15118 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL1241608 0.86 EIF4E (0.41) EIF4EMEN1KMT2ASMN1; SMN2MITF
SCHEMBL15434064 0.83 TSHR (0.46) EIF4EMEN1KMT2ASMN1; SMN2MITF
SCHEMBL21708228 0.82 ALDH1A1 (0.51) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL1239749 0.81 ATM (0.46) EIF4EMEN1KMT2ASMN1; SMN2MITF
SCHEMBL13809398 0.80 EIF4E (0.44) EIF4EMEN1KMT2ASMN1; SMN2MITF
SCHEMBL1242402 0.80 MAPT (0.55) EIF4EMEN1KMT2ASMN1; SMN2TXNRD1
SCHEMBL1242343 0.78 CNR2 (0.44) EIF4EMEN1KMT2ASMN1; SMN2MITF
SCHEMBL1242400 0.78 CYP19A1 (0.43) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL1242451 0.77 ALOX5AP (0.40) MAPTPTPN5FFAR4FFAR1FPR2
SCHEMBL9940716 0.74 ALDH1A1 (0.51) MEN1KMT2AMAPTHTTPDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8633245-B2 PAI-1 inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2014-01-21 US disclosed
US-8633245-B2 PAI-1 inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2014-01-21 US disclosed
US-7884234-B2 N-[4-(tert-butyl)benzyl]-N-[4 -(trifluoromethoxy)biphenyl-3-yl]oxamic Acid; Inhibitors of plasminogen activator inhibitor-1 (PAI-1); thrombogenesis, fibrogenesis, accumulation of visceral fat, cell proliferation, angiogenesis INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2011-02-08 US disclosed
US-7884234-B2 N-[4-(tert-butyl)benzyl]-N-[4 -(trifluoromethoxy)biphenyl-3-yl]oxamic Acid; Inhibitors of plasminogen activator inhibitor-1 (PAI-1); thrombogenesis, fibrogenesis, accumulation of visceral fat, cell proliferation, angiogenesis INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2011-02-08 US disclosed
US-20090312315-A1 PAI-1 INHIBITOR INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-12-17 US disclosed
US-20090215899-A9 N-Phenyloxamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-08-27 US disclosed
US-20090215899-A9 N-Phenyloxamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-08-27 US disclosed
EP-2072498-A1 N-PHENYLOXAMIDIC ACID DERIVATIVE Institute of Medicinal Molecular Design, Inc. (JP) 2009-06-24 EP disclosed
US-20080249175-A1 N-Phenyloxamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2008-10-09 US disclosed
US-20080249175-A1 N-Phenyloxamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2008-10-09 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 (3 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-20080249175-A1 N-Phenyloxamide derivatives SERPINE1, SERPINH1, F12 EIF4E 2980/4885MEN1 1711/4885KMT2A 2850/4885
US-20090215899-A9 N-Phenyloxamide derivatives SERPINE1, SERPINH1, F12 EIF4E 2980/4885MEN1 1711/4885KMT2A 2850/4885
US-20090312315-A1 PAI-1 INHIBITOR SERPINC1, SERPINE1, SERPINH1 EIF4E 1956/4885MEN1 210/4885KMT2A 2586/4885

“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.