SCHEMBL7991660

SCHEMBL7991660

CCOc1ccc(-c2[nH]c(-c3cccc([N+](=O)[O-])c3)nc2C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.49
▸ MEN1 O00255 6/20 0.49
▸ KMT2A Q03164 6/20 0.49
▸ HTT P42858 3/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ LMNA P02545 2/20 0.49
▸ GAA P10253 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ MMP13 P45452 2/20 0.46
▸ MMP2 P08253 1/20 0.46
▸ MMP9 P14780 1/20 0.46
▸ MMP8 P22894 1/20 0.46
▸ CYP1A2 P05177 2/20 0.45
▸ CYP2D6 P10635 2/20 0.45
▸ CYP2C19 P33261 2/20 0.45
▸ GUSB P08236 1/20 0.44
▸ ALOX5 P09917 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
SCHEMBL7988260 0.90 MAPT (0.51) MAPTMEN1KMT2AHTTALDH1A1
SCHEMBL7989904 0.89 MEN1 (0.54) MAPTMEN1KMT2AHTTALDH1A1
SCHEMBL7991748 0.89 CHEK2 (0.50) MAPTMEN1KMT2AHTTALDH1A1
SCHEMBL7978081 0.83 MAPT (0.52) MAPTMEN1KMT2AHTTALDH1A1
SCHEMBL7988193 0.83 MAPT (0.52) MAPTMEN1KMT2AHTTALDH1A1
SCHEMBL7990033 0.83 MAPT (0.51) MAPTMEN1KMT2AHTTALDH1A1
SCHEMBL7989208 0.82 PIN1 (0.61) MAPTMEN1KMT2AHTTALDH1A1
SCHEMBL7995168 0.82 MAPT (0.51) MAPTMEN1KMT2AHTTALDH1A1
SCHEMBL7991934 0.79 MAPT (0.52) MAPTMEN1KMT2AHTTALDH1A1
SCHEMBL7991863 0.79 MAPT (0.52) MAPTMEN1KMT2AHTTALDH1A1

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
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