SCHEMBL6754385

SCHEMBL6754385

O=CNc1ccc(F)c([N+](=O)[O-])c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.54
MEN1 O00255 6/20 0.54
KMT2A Q03164 6/20 0.54
MAPT P10636 4/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
HTT P42858 2/20 0.54
CA1 P00915 1/20 0.54
MMP2 P08253 1/20 0.54
CA14 Q9ULX7 1/20 0.54
ALDH1A1 P00352 5/20 0.53
HIF1A Q16665 1/20 0.53
VCAM1 P19320 1/20 0.50
RECQL P46063 1/20 0.47
GAA P10253 1/20 0.47
TRPV1 Q8NER1 1/20 0.45
POLB P06746 1/20 0.45
MAPK1 P28482 1/20 0.44
RAB9A P51151 1/20 0.44
MCL1 Q07820 1/20 0.44
HCRTR1 O43613 1/20 0.44

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
SCHEMBL4220780 0.84 TSHR (0.47) LMNAMAPTHTTCA1MMP2
SCHEMBL7528440 0.79 ALDH1A1 (0.55) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL7530821 0.79 VCAM1 (0.62) LMNAMEN1KMT2AMAPTHTT
SCHEMBL27685352 0.79 MAPT (0.55) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL7380541 0.79 LMNA (0.56) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6023486 0.79 LMNA (0.56) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL27582538 0.79 LMNA (0.68) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6717028 0.78 LMNA (0.64) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL2137755 0.77 LMNA (0.55) LMNAMEN1KMT2AMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL27844722 0.77 LMNA (0.55) LMNAMEN1KMT2AMAPTSMN1; 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP claimed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US claimed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO claimed
US-20040087798-A1 Novel amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 US disclosed
EP-1264820-A1 NOVEL AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-12-11 EP disclosed
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP disclosed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US disclosed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO disclosed
US-4933355-A ALDOSE REDUCTASE INHIBITORS SANKYO COMPANY LIMITED (JP) 1990-06-12 US disclosed
EP-0337819-A1 Thiazole derivatives, their preparation and their use in the treatment of diabetes complications Sankyo Company Limited (JP) 1989-10-18 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-20040087798-A1 Novel amide compounds H1-2, H1-0, H1-3 LMNA 2223/4885MEN1 970/4885KMT2A 130/4885

“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.