SCHEMBL6601595

SCHEMBL6601595

CC(C)(C)c1csc(-c2cc3cc(Cc4nc(C(=O)O)cs4)ccc3o2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 1/20 0.39
CYP26B1 Q9NR63 1/20 0.39
ALDH1A1 P00352 2/20 0.39
HDAC1 Q13547 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
ACHE P22303 1/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
MMP13 P45452 1/20 0.36
FFAR1 O14842 2/20 0.35
LMNA P02545 3/20 0.35
NPC1 O15118 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
RAB9A P51151 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.35
TP53 P04637 1/20 0.34

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
SCHEMBL6599628 0.88 RAB9A (0.42) ALDH1A1MMP1MMP13NPC1RAB9A
SCHEMBL6596825 0.86 CYP26A1 (0.45) CYP26A1CYP26B1ALDH1A1HDAC1HDAC6
SCHEMBL6597050 0.82 RAB9A (0.37) CYP26A1CYP26B1ALDH1A1LMNANPC1
SCHEMBL8311016 0.81 CYP26B1 (0.42) CYP26A1CYP26B1ALDH1A1FFAR1LMNA
SCHEMBL8311225 0.81 CYP26A1 (0.42) CYP26A1CYP26B1ALDH1A1FFAR1LMNA
SCHEMBL8310165 0.81 FFAR1 (0.56) CYP26A1CYP26B1FFAR1LMNANPC1
SCHEMBL6598204 0.81 ALKBH2 (0.39) ALDH1A1HDAC1HDAC8HDAC6FFAR1
SCHEMBL6598966 0.81 ALDH1A1 (0.43) ALDH1A1LMNANPC1SMN1; SMN2RAB9A
SCHEMBL8310276 0.81 CHRM2 (0.41) CYP26A1CYP26B1ALDH1A1FFAR1LMNA
SCHEMBL6598772 0.80 TP53 (0.45) CYP26A1CYP26B1ALDH1A1HDAC6LMNA

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