SCHEMBL8419798

SCHEMBL8419798

C=CC(CSCC(C=C)OCc1ccccc1)OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
SLC1A3 P43003 2/20 0.37
SLC1A2 P43004 2/20 0.37
SLC1A1 P43005 2/20 0.37
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
KMT2A Q03164 1/20 0.37
IDO1 P14902 1/20 0.36
AGXT P21549 1/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA7 P43166 2/20 0.35
CA9 Q16790 2/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
RCE1 Q9Y256 1/20 0.33

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
SCHEMBL13392800 0.80 SLC1A3 (0.41) TSHRSLC1A3SLC1A2SLC1A1MEN1
SCHEMBL28797022 0.80 MEN1 (0.45) TSHRSLC1A3SLC1A2SLC1A1MEN1
SCHEMBL6120141 0.80 TSHR (0.40) TSHRSLC1A3SLC1A2SLC1A1MEN1
SCHEMBL357592 0.80 TSHR (0.40) TSHRSLC1A3SLC1A2SLC1A1MEN1
SCHEMBL357591 0.80 TSHR (0.40) TSHRSLC1A3SLC1A2SLC1A1MEN1
SCHEMBL8419732 0.80 TSHR (0.45) TSHRSLC1A3SLC1A2SLC1A1MEN1
SCHEMBL11447748 0.79 CA1 (0.50) TSHRSLC1A1MEN1KMT2ACA1
SCHEMBL28886016 0.77 CA1 (0.38) TSHRSLC1A3SLC1A2SLC1A1MEN1
SCHEMBL7116036 0.75 TSHR (0.46) TSHRSLC1A3SLC1A2SLC1A1MEN1
SCHEMBL24529245 0.75 SLC6A2 (0.36) TSHRSLC1A3SLC1A2SLC1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0609061-B1 Polymerizable composition, polymer, organic glass and ophthalmic lens TOKUYAMA CORP (JP) 1999-09-29 EP claimed
US-5475074-A Copolamerizable monomers containing vinyl benzyl compound, 2,4-diphenyl-4-methyl-1-pentene and an acrylic momomer; also contains mercapto, hindered phenol and azo compounds; high refractive index, heat and radiation resistance TOKUYAMA CORPORATION (JP) 1995-12-12 US claimed
EP-0609061-A2 Polymerizable composition, polymer, organic glass and ophthalmic lens TOKUYAMA CORPORATION (JP) 1994-08-03 EP claimed
JP-6116337-A None JP disclosed
EP-0609061-B1 Polymerizable composition, polymer, organic glass and ophthalmic lens TOKUYAMA CORP (JP) 1999-09-29 EP disclosed
US-5475074-A Copolamerizable monomers containing vinyl benzyl compound, 2,4-diphenyl-4-methyl-1-pentene and an acrylic momomer; also contains mercapto, hindered phenol and azo compounds; high refractive index, heat and radiation resistance TOKUYAMA CORPORATION (JP) 1995-12-12 US disclosed
EP-0609061-A2 Polymerizable composition, polymer, organic glass and ophthalmic lens TOKUYAMA CORPORATION (JP) 1994-08-03 EP disclosed
JP-H06116337-A POLYMERIZABLE COMPOSITION TOKUYAMA SODA CO LTD 1994-04-26 JP disclosed