SCHEMBL28049882

SCHEMBL28049882

C=C(C)C(=O)OCCOCNCC

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.67
TSHR P16473 6/20 0.50
ALDH1A1 P00352 5/20 0.40
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
HSD17B10 Q99714 1/20 0.31
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31

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
SCHEMBL30748195 0.87 THRB (0.65) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL3589369 0.84 THRB (0.48) THRBTSHRALDH1A1POLBAPEX1
Propane SCHEMBL9320578 0.82 THRB (0.80) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL672102 0.82 THRB (0.79) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL9314009 0.82 THRB (0.79) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL2367616 0.82 THRB (0.79) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL9485961 0.82 THRB (0.79) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL22166147 0.82 THRB (0.79) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL700642 0.82 THRB (0.79) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL5959895 0.82 THRB (0.79) THRBTSHRALDH1A1POLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105319848-B Colored curable resin composition 住友化学株式会社 2021-03-26 CN disclosed
CN-105589297-B Colored curable resin composition 住友化学株式会社 2021-02-19 CN disclosed
CN-105573055-B Colored curable resin composition 住友化学株式会社 2020-11-17 CN disclosed
CN-107111230-B Colored curable resin composition 东友精细化工有限公司 2020-09-08 CN disclosed
CN-105198831-B Compound and colored curable resin composition 东友精细化工有限公司 2020-08-07 CN disclosed
CN-107111230-A Colored curable resin composition 东友精细化工有限公司 2017-08-29 CN disclosed
CN-105198831-A Compound and coloring curable resin composition DONGWOO FINE CHEM CO LTD 2015-12-30 CN disclosed