SCHEMBL6598966

SCHEMBL6598966

CCOC(=O)Cc1csc(Cc2ccc3oc(-c4nc(C(C)(C)C)cs4)cc3c2)n1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
MAPT P10636 3/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 2/20 0.43
PIK3CA P42336 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
LMNA P02545 2/20 0.39
GALR3 O60755 1/20 0.39
POLB P06746 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ESR2 Q92731 1/20 0.38
PKM P14618 1/20 0.38
HTT P42858 1/20 0.38
GAA P10253 1/20 0.38
KDM4E B2RXH2 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL6596825 0.88 CYP26A1 (0.45) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL6599628 0.86 RAB9A (0.42) ALDH1A1MAPTNPC1RAB9AMEN1
SCHEMBL6599461 0.83 FFAR1 (0.41) ALDH1A1MAPTNPC1RAB9AMEN1
SCHEMBL6597050 0.82 RAB9A (0.37) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL6601595 0.81 CYP26A1 (0.39) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL6607922 0.80 MAPT (0.33) ALDH1A1MAPTNPC1RAB9AMEN1
SCHEMBL8311230 0.80 CA12 (0.37) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL6599372 0.77
SCHEMBL8310276 0.75 CHRM2 (0.41) ALDH1A1MAPTNPC1RAB9AMEN1
SCHEMBL8314166 0.75 CA12 (0.41) ALDH1A1MAPTNPC1RAB9AMEN1

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