SCHEMBL6598980

SCHEMBL6598980

COC(=O)COc1cccc2c(C#N)cn(Cc3ccc4oc(-c5nc(C(C)(C)C)cs5)cc4c3)c12

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.33
TSHR P16473 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
AR P10275 1/20 0.32
ADORA2A P29274 1/20 0.32
HTT P42858 2/20 0.31
KDM4E B2RXH2 2/20 0.31
CTDSP1 Q9GZU7 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MAOB P27338 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
JAK2 O60674 1/20 0.31
CYP26A1 O43174 1/20 0.31
CYP26B1 Q9NR63 1/20 0.31
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
LMNA P02545 1/20 0.30
MAPK1 P28482 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL6598952 0.80 XDH (0.36)
SCHEMBL6599016 0.78 XDH (0.38)
SCHEMBL6602878 0.77 PLA2G4A (0.39)
SCHEMBL6599799 0.77 XDH (0.38) NPSR1MEN1KMT2AMAPT
SCHEMBL6598004 0.76 XDH (0.34)
SCHEMBL6601989 0.76 XDH (0.34)
SCHEMBL6599129 0.76 MEN1 (0.33) TSHRHTTKDM4ETDP1MEN1
SCHEMBL6600645 0.76 MAOB (0.37) TDP1MAOBLMNAALDH1A1
SCHEMBL6622209 0.76 FFAR1 (0.40)
SCHEMBL14106844 0.76 XDH (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1170009-B1 Thiazolybenzofuran derivatives and their use as SRS-A and leukotiene antagonists FUJISAWA PHARMACEUTICAL CO (JP) 2004-04-07 EP disclosed
EP-1170009-A2 Thiazolybenzofuran derivatives and their use as SRS-A and leukotiene antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-09 EP disclosed
US-5994378-A ANTIALLERGENS; ANTIINFLAMMATORY AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-11-30 US disclosed
EP-0880519-A1 THIAZOLYLBENZOFURAN DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-12-02 EP disclosed
WO-1997027190-A1 THIAZOLYLBENZOFURAN DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-07-31 WO disclosed