SCHEMBL28263167

SCHEMBL28263167

C=CCOC(=O)CC(CCCCCCCCC)C(=O)OCC=C

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.59
TDP1 Q9NUW8 1/20 0.41
CA2 P00918 2/20 0.40
ZDHHC7 Q9NXF8 1/20 0.38
GPR84 Q9NQS5 6/20 0.37
LMNA P02545 2/20 0.37
CA1 P00915 1/20 0.37
GRIK1 P39086 1/20 0.36
GRIK2 Q13002 1/20 0.36
BIRC2 Q13490 2/20 0.36
ALDH1A1 P00352 1/20 0.35
PRKCD Q05655 2/20 0.35

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
SCHEMBL11329033 1.00 TSHR (0.59) TSHRTDP1CA2ZDHHC7GPR84
SCHEMBL28316873 0.89 TSHR (0.59) TSHRTDP1CA2ZDHHC7GPR84
SCHEMBL22598174 0.89 TSHR (0.59) TSHRTDP1CA2ZDHHC7GPR84
SCHEMBL28546607 0.89 TSHR (0.59) TSHRTDP1CA2ZDHHC7GPR84
SCHEMBL22598334 0.89 TSHR (0.59) TSHRTDP1CA2ZDHHC7GPR84
SCHEMBL28545057 0.89 TSHR (0.59) TSHRTDP1CA2ZDHHC7GPR84
SCHEMBL22598182 0.89 TSHR (0.59) TSHRTDP1CA2ZDHHC7GPR84
SCHEMBL21653829 0.87 TSHR (0.57) TSHRTDP1CA2ZDHHC7GPR84
SCHEMBL4006585 0.86 TSHR (0.48) TSHRTDP1CA2ZDHHC7GPR84
SCHEMBL28738803 0.86 TSHR (0.56) TSHRTDP1CA2ZDHHC7GPR84

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-109071936-A Composition for laminate 株式会社大阪曹达 2018-12-21 CN disclosed