SCHEMBL7988461

SCHEMBL7988461

CCOC(=O)c1nc(-c2ccc([N+](=O)[O-])cc2)[nH]c1-c1cccc(OC)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.50
PLAU P00749 1/20 0.50
ELANE P08246 1/20 0.50
CTRB1 P17538 1/20 0.50
PIN1 Q13526 1/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
AR P10275 2/20 0.47
HCRTR1 O43613 1/20 0.47
MAPT P10636 5/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
RAB9A P51151 3/20 0.47
LMNA P02545 3/20 0.47
NPC1 O15118 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
GAA P10253 2/20 0.47
NPBWR1 P48145 2/20 0.47
NFKB1 P19838 1/20 0.47
MAPK1 P28482 1/20 0.47

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
SCHEMBL7991879 0.92 MAPT (0.51) F2PLAUELANECTRB1PIN1
SCHEMBL7988102 0.89 MAPT (0.54) ARMAPTMEN1KMT2ARAB9A
SCHEMBL7988557 0.87 PIN1 (0.58) PIN1KDM4EALDH1A1MAPTMEN1
SCHEMBL7989862 0.87 AR (0.54) ALDH1A1ARMAPTMEN1KMT2A
SCHEMBL28914603 0.87 AR (0.54) ALDH1A1ARMAPTMEN1KMT2A
SCHEMBL7992024 0.87 AR (0.58) ARMAPTMEN1KMT2ARAB9A
SCHEMBL7995168 0.86 MAPT (0.51) F2PLAUELANECTRB1ALDH1A1
SCHEMBL7988441 0.84 AR (0.55) ALDH1A1ARMAPTMEN1KMT2A
SCHEMBL7977720 0.83 AR (0.52) ARMAPTMEN1KMT2ARAB9A
SCHEMBL7995187 0.82 AR (0.53) ALDH1A1ARMAPTMEN1KMT2A

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