SCHEMBL7364185

SCHEMBL7364185

COc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2NC2CCCC2)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
MAPT P10636 4/20 0.54
KMT2A Q03164 3/20 0.52
GABRP O00591 1/20 0.50
GABRD O14764 1/20 0.50
GABRA1 P14867 1/20 0.50
GABRB1 P18505 1/20 0.50
GABRG2 P18507 1/20 0.50
GABRB3 P28472 1/20 0.50
GABRA5 P31644 1/20 0.50
GABRA3 P34903 1/20 0.50
GABRA2 P47869 1/20 0.50
GABRB2 P47870 1/20 0.50
GABRA4 P48169 1/20 0.50
GABRE P78334 1/20 0.50
GABRA6 Q16445 1/20 0.50
GABRG1 Q8N1C3 1/20 0.50
GABRG3 Q99928 1/20 0.50
GABRQ Q9UN88 1/20 0.50

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
SCHEMBL6937265 0.93 GABRP (0.51) NPSR1L3MBTL1MAPTKMT2AGABRP
SCHEMBL6939423 0.93 GABRP (0.51) NPSR1L3MBTL1MAPTKMT2AGABRP
SCHEMBL6942756 0.93 NPSR1 (0.54) NPSR1L3MBTL1MAPTKMT2AGABRP
SCHEMBL6937261 0.93 GABRP (0.51) NPSR1L3MBTL1MAPTKMT2AGABRP
SCHEMBL6942691 0.92 NPSR1 (0.48) NPSR1L3MBTL1MAPTKMT2AGABRP
SCHEMBL6944249 0.92 GABRP (0.50) NPSR1L3MBTL1MAPTKMT2AGABRP
SCHEMBL2681785 0.92 NPSR1 (0.48) NPSR1L3MBTL1MAPTKMT2AGABRP
SCHEMBL6938934 0.92 NPSR1 (0.48) NPSR1L3MBTL1MAPTKMT2AGABRP
SCHEMBL6938938 0.92 NPSR1 (0.48) NPSR1L3MBTL1MAPTKMT2AGABRP
SCHEMBL6940886 0.91 NPSR1 (0.48) NPSR1L3MBTL1MAPTKMT2AGABRP

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
WO-2001030745-A1 ANTHRANILIC ACID DERIVATIVES AS INHIBITORS OF THE CGMP-PHOSPHODIESTERASE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-03 WO disclosed