Bupirimate

Bupirimate

SCHEMBL5072162

CCCCc1c(C)nc(NCC)nc1OS(=O)(=O)N(C)C.Cc1cc(C2CC2)nc(Nc2ccccc2)n1

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH3 Q9ULD8 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
MAPT P10636 4/20 0.34
LMNA P02545 3/20 0.34
HTT P42858 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
XBP1 P17861 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34
SLC2A1 P11166 1/20 0.32
IGF1R P08069 3/20 0.32
TSHR P16473 2/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
Bupirimate SCHEMBL22961 0.78 TLR8 (0.33) MAPTHTTALDH1A1GAAHPGD
Bupirimate SCHEMBL29394855 0.78 TLR8 (0.33) MAPTHTTALDH1A1GAAHPGD
Bupirimate SCHEMBL29177491 0.77 TLR8 (0.32) MAPTHTTALDH1A1GAAL3MBTL1
Bupirimate SCHEMBL6008749 0.77 TLR8 (0.32) MAPTHTTALDH1A1GAAL3MBTL1
Cyprodinil SCHEMBL22669 0.71 TAAR1 (0.55) KCNH3TAAR1MAPTLMNAHTT
Cyprodinil SCHEMBL29421756 0.71 TAAR1 (0.55) KCNH3TAAR1MAPTLMNAHTT
Cyprodinil SCHEMBL12471945 0.70 SMN1; SMN2 (0.54) TAAR1MAPTLMNAHTTSMN1; SMN2
Cyprodinil SCHEMBL20856299 0.69 KCNH3 (0.43) KCNH3TAAR1HTTSMN1; SMN2SLC2A1
Cyprodinil SCHEMBL20856218 0.68 KCNH3 (0.40) KCNH3TAAR1HTTSMN1; SMN2SLC2A1
Cyprodinil SCHEMBL20856252 0.68 SLC2A1 (0.39) KCNH3TAAR1SMN1; SMN2SLC2A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1893348-A2 IMPROVED MICRONIZED WOOD PRESERVATIVE COMPOSITIONS Osmose, Inc. (US) 2008-03-05 EP disclosed
WO-2007002156-A2 IMPROVED MICRONIZED WOOD PRESERVATIVE COMPOSITIONS OSMOSE, INC. (US) 2007-01-04 WO disclosed