SCHEMBL7991879

SCHEMBL7991879

CCOC(=O)c1nc(-c2cccc([N+](=O)[O-])c2)[nH]c1-c1cccc(OC)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.51
PIN1 Q13526 1/20 0.51
ALDH1A1 P00352 4/20 0.50
KDM4E B2RXH2 1/20 0.50
F2 P00734 1/20 0.50
PLAU P00749 1/20 0.50
ELANE P08246 1/20 0.50
CTRB1 P17538 1/20 0.50
HCRTR1 O43613 1/20 0.49
ADORA2A P29274 1/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
RAB9A P51151 3/20 0.48
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47
MMP8 P22894 1/20 0.47
MMP13 P45452 1/20 0.47
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46

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
SCHEMBL7988461 0.92 F2 (0.50) MAPTPIN1ALDH1A1KDM4EF2
SCHEMBL7995168 0.92 MAPT (0.51) MAPTALDH1A1F2PLAUELANE
SCHEMBL7989208 0.87 PIN1 (0.61) MAPTPIN1ALDH1A1HCRTR1ADORA2A
SCHEMBL7988260 0.86 MAPT (0.51) MAPTALDH1A1HCRTR1MEN1KMT2A
SCHEMBL7991863 0.85 MAPT (0.52) MAPTALDH1A1KDM4EHCRTR1MEN1
SCHEMBL7991934 0.85 MAPT (0.52) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL7988102 0.81 MAPT (0.54) MAPTMEN1KMT2ARAB9AMMP2
SCHEMBL7989904 0.79 MEN1 (0.54) MAPTPIN1ALDH1A1KDM4EPLAU
SCHEMBL7988557 0.79 PIN1 (0.58) MAPTPIN1ALDH1A1KDM4EMEN1
SCHEMBL7991730 0.79 MEN1 (0.56) MAPTALDH1A1KDM4EPLAUHCRTR1

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