SCHEMBL28546607

SCHEMBL28546607

C=CCOC(=O)C(CCCCCC)CCCCCCCC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.59
CA2 P00918 2/20 0.46
ZDHHC7 Q9NXF8 1/20 0.43
CA1 P00915 1/20 0.42
PRKCD Q05655 2/20 0.41
GRIK1 P39086 2/20 0.41
GRIK2 Q13002 2/20 0.41
GPR84 Q9NQS5 3/20 0.40
FFAR1 O14842 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
CPB2 Q96IY4 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
LCK P06239 1/20 0.39
PPARD Q03181 1/20 0.39
ZDHHC20 Q5W0Z9 1/20 0.39
ZDHHC2 Q9UIJ5 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
FAAH O00519 1/20 0.39

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
SCHEMBL22598334 1.00 TSHR (0.59) TSHRCA2ZDHHC7CA1PRKCD
SCHEMBL28316873 1.00 TSHR (0.59) TSHRCA2ZDHHC7CA1PRKCD
SCHEMBL28545057 1.00 TSHR (0.59) TSHRCA2ZDHHC7CA1PRKCD
SCHEMBL22598174 1.00 TSHR (0.59) TSHRCA2ZDHHC7CA1PRKCD
SCHEMBL22598182 1.00 TSHR (0.59) TSHRCA2ZDHHC7CA1PRKCD
SCHEMBL21653829 0.98 TSHR (0.57) TSHRCA2ZDHHC7CA1PRKCD
SCHEMBL28738803 0.97 TSHR (0.56) TSHRCA2ZDHHC7CA1PRKCD
SCHEMBL28562995 0.96 TSHR (0.54) TSHRCA2ZDHHC7CA1PRKCD
SCHEMBL15442774 0.93 TSHR (0.56) TSHRCA2ZDHHC7CA1GRIK1
SCHEMBL9772503 0.93 TSHR (0.56) TSHRCA2ZDHHC7CA1GRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108350252-B Epoxy reactive diluent and epoxy resin composition containing same 日产化学工业株式会社 2021-04-09 CN disclosed