SCHEMBL6182016

SCHEMBL6182016

CCCCCS(=O)(=O)NC(=O)c1ccc([N+](=O)[O-])c(N)c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.45
PTPN1 P18031 2/20 0.45
LMNA P02545 2/20 0.43
POLB P06746 1/20 0.43
PPARG P37231 1/20 0.43
TXNRD1 Q16881 4/20 0.42
HCAR3 P49019 2/20 0.42
GSR P00390 1/20 0.42
MAPT P10636 3/20 0.41
ALDH1A1 P00352 4/20 0.40
ASAH2 Q9NR71 1/20 0.40
GAA P10253 3/20 0.40
HPGD P15428 1/20 0.40
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
AKR1C1 Q04828 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL6171135 0.96 MAPK1 (0.46) MAPK1PTPN1LMNAPOLBPPARG
SCHEMBL6183184 0.83 KMT2A (0.45) MAPK1PTPN1LMNAPOLBPPARG
SCHEMBL6172349 0.80 KMT2A (0.46) MAPK1PTPN1LMNAPOLBHCAR3
SCHEMBL6181163 0.77 PPARG (0.55) MAPK1LMNAPPARGMAPTALDH1A1
SCHEMBL6168841 0.77 KMT2A (0.57) MAPK1LMNAPOLBHCAR3MAPT
SCHEMBL8665981 0.76 KDM4E (0.54) PTPN1LMNAMAPTALDH1A1GAA
SCHEMBL6170076 0.74 PPARG (0.51) MAPK1LMNAPPARGMAPTALDH1A1
SCHEMBL6168579 0.74 ERAP2 (0.47) PTPN1PPARGMAPTALDH1A1GAA
SCHEMBL6171844 0.73 MAPK1 (0.59) MAPK1PTPN1LMNAGAAMEN1
SCHEMBL8074054 0.73 MAPK1 (0.48) MAPK1LMNAPOLBHCAR3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1000932-B9 AROMATIC RING DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2005-12-28 EP disclosed
EP-1000932-B1 AROMATIC RING DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2004-09-15 EP disclosed
US-6242474-B1 SULFONYLCARBAMOYLALKYLIMIDAZOLE DERIVATIVES; ANTIDIABETIC AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-06-05 US disclosed
EP-1000932-A1 AROMATIC RING DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-05-17 EP disclosed