SCHEMBL28181728

SCHEMBL28181728

C=CC(=O)OCCCOC(=O)CCC(=O)OC

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.57
ALDH1A1 P00352 4/20 0.57
CYP3A4 P08684 1/20 0.57
HPGD P15428 1/20 0.56
TP53 P04637 2/20 0.47
HIF1A Q16665 2/20 0.47
HSD17B10 Q99714 1/20 0.47
LMNA P02545 2/20 0.44
THRB P10828 2/20 0.40
ADRA2A P08913 1/20 0.38
ADRA1A P35348 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPT P10636 1/20 0.37
BLM P54132 1/20 0.37
ATM Q13315 1/20 0.37
HTR2C P28335 1/20 0.37
DGKA P23743 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL10080348 0.96 TSHR (0.62) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL2611999 0.93 TSHR (0.55) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL10493413 0.91 TSHR (0.68) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL12744514 0.90 TSHR (0.63) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL5935034 0.89 TSHR (0.61) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL25822549 0.88 TSHR (0.66) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL17696341 0.88 TSHR (0.66) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL2612362 0.87 TSHR (0.64) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL26093280 0.87 TSHR (0.75) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL12270648 0.86 TSHR (0.68) TSHRALDH1A1CYP3A4HPGDTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108699405-A Transparent double-sided adhesive sheet and adhesive sheet laminate 三菱化学株式会社 2018-10-23 CN disclosed
CN-107394090-A Barrier film for rechargeable battery and the lithium rechargeable battery group comprising it 三星SDI株式会社 2017-11-24 CN disclosed