SCHEMBL7992254

SCHEMBL7992254

CCOC(=O)c1nc(-c2ccc([N+](=O)[O-])cc2)[nH]c1-c1ccc(F)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
RAB9A P51151 3/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
ALOX5 P09917 2/20 0.54
MAPK13 O15264 1/20 0.54
RIPK2 O43353 1/20 0.54
GMNN O75496 1/20 0.54
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
TP53 P04637 1/20 0.54
CYP3A4 P08684 1/20 0.54
THRB P10828 1/20 0.54
ALOX15 P16050 1/20 0.54
NFKB1 P19838 1/20 0.54
MAPK1 P28482 1/20 0.54
THPO P40225 1/20 0.54
MTOR P42345 1/20 0.54
RECQL P46063 1/20 0.54
MAPK12 P53778 1/20 0.54

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
SCHEMBL7992024 0.94 AR (0.58) MAPTRAB9AMEN1KMT2AMAPK14
SCHEMBL7988441 0.91 AR (0.55) MAPTRAB9AMEN1KMT2AALDH1A1
SCHEMBL7989862 0.90 AR (0.54) MAPTRAB9AMEN1KMT2AALDH1A1
SCHEMBL28914603 0.90 AR (0.54) MAPTRAB9AMEN1KMT2AALDH1A1
SCHEMBL7995187 0.89 AR (0.53) MAPTRAB9AMEN1KMT2AALOX5
SCHEMBL7991863 0.89 MAPT (0.52) MAPTRAB9AMEN1KMT2AALOX5
SCHEMBL7991922 0.89 AR (0.50) MAPTRAB9AMEN1KMT2AALOX5
SCHEMBL7977720 0.88 AR (0.52) MAPTRAB9AMEN1KMT2ALMNA
SCHEMBL7988102 0.88 MAPT (0.54) MAPTRAB9AMEN1KMT2ALMNA
SCHEMBL7977722 0.87 NPBWR1 (0.53) MAPTRAB9AMEN1KMT2AMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed