SCHEMBL28055784

SCHEMBL28055784

C=CC1OC(C=O)OC1CCCCCCCCC

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
POLB P06746 1/20 0.33
FASN P49327 1/20 0.33
ALDH1A1 P00352 1/20 0.32
SPHK1 Q9NYA1 4/20 0.31
SPHK2 Q9NRA0 3/20 0.31
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31
ALOX5 P09917 1/20 0.30
HMGCR P04035 1/20 0.30
DAGLA Q9Y4D2 1/20 0.30
EPHX1 P07099 1/20 0.30
PRKCA P17252 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
SCHEMBL27692179 1.00 TSHR (0.34) TSHRPOLBFASNALDH1A1SPHK1
SCHEMBL27692084 0.93 ALDH1A1 (0.30) TSHRALDH1A1
SCHEMBL13863985 0.84 TSHR (0.43) TSHRPOLBFASNALDH1A1SPHK1
SCHEMBL4447205 0.84 TSHR (0.43) TSHRPOLBFASNALDH1A1SPHK1
SCHEMBL8782117 0.84 TSHR (0.43) TSHRPOLBFASNALDH1A1SPHK1
SCHEMBL4447210 0.84 TSHR (0.43) TSHRPOLBFASNALDH1A1SPHK1
SCHEMBL4447204 0.84 TSHR (0.43) TSHRPOLBFASNALDH1A1SPHK1
SCHEMBL7033921 0.82 TSHR (0.39) TSHRPOLBFASNALDH1A1SPHK1
SCHEMBL15093177 0.82 TSHR (0.39) TSHRPOLBFASNALDH1A1SPHK1
SCHEMBL27488782 0.79

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
CN-108424745-A Active energy ray polymer resin composition, bonding agent, smears, laminated body and laminated body used for optical elements 东洋油墨SC控股株式会社 2018-08-21 CN disclosed
CN-105358584-B Active energy ray-polymerizable resin composition, adhesive, coating agent, laminate, and laminate for optical element 东洋油墨SC控股株式会社 2018-04-27 CN disclosed
CN-105358584-A Active energy ray-polymerizable resin composition and laminate TOYO INK SC HOLDINGS CO LTD 2016-02-24 CN disclosed