SCHEMBL6607922

SCHEMBL6607922

CC(C)(C)c1csc(-c2cc3cc(Cc4nc(CC#N)cs4)ccc3o2)n1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
HBB P68871 1/20 0.33
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP26A1 O43174 1/20 0.31
CYP26B1 Q9NR63 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
SCHEMBL6601742 0.88 ALDH1A1 (0.36) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL6597050 0.87 RAB9A (0.37) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL6596825 0.83 CYP26A1 (0.45) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL6599372 0.81
SCHEMBL6598966 0.80 ALDH1A1 (0.43) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL6601595 0.79 CYP26A1 (0.39) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL8310276 0.78 CHRM2 (0.41) MAPTNPC1RAB9AALDH1A1MEN1
SCHEMBL5800338 0.78 CYP26A1 (0.37) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL8314615 0.77 MAPT (0.33) MAPTNPC1RAB9AHBBALDH1A1
SCHEMBL8314939 0.77 MAOB (0.34) MAPTALDH1A1KDM4EMEN1KMT2A

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 3 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