SCHEMBL28110146

SCHEMBL28110146

C=CC(=O)NOCCCCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 2/20 0.52
ZDHHC2 Q9UIJ5 1/20 0.52
TSHR P16473 3/20 0.46
HPGD P15428 1/20 0.46
CNR2 P34972 2/20 0.41
TRPV1 Q8NER1 2/20 0.41
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
EPHX1 P07099 1/20 0.40
FAAH O00519 3/20 0.40
CNR1 P21554 1/20 0.39
HTR2C P28335 1/20 0.39
EPHX2 P34913 1/20 0.38
NAAA Q02083 1/20 0.38
HCAR2 Q8TDS4 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CES2 O00748 1/20 0.37
PLA2G2C Q5R387 1/20 0.37

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
SCHEMBL27872959 0.98 ZDHHC20 (0.55) ZDHHC20ZDHHC2TSHRHPGDCNR2
SCHEMBL194102 0.94 TSHR (0.52) ZDHHC20ZDHHC2TSHRHPGDCNR2
SCHEMBL176017 0.86
SCHEMBL27609273 0.84 TSHR (0.43) ZDHHC20ZDHHC2TSHRHPGDCNR2
Methacrylic Acid SCHEMBL27482178 0.82 TSHR (0.41) ZDHHC20ZDHHC2TSHRHPGDCNR2
SCHEMBL27578764 0.80 ALDH1A1 (0.36) TSHRMAPT
Methacrylic Acid SCHEMBL27482177 0.78 TSHR (0.45) ZDHHC20ZDHHC2TSHRHPGDCNR2
SCHEMBL27425076 0.78 ACHE (0.39) ZDHHC20ZDHHC2TSHRHPGDMAPT
SCHEMBL27570362 0.78 TSHR (0.38) ZDHHC20ZDHHC2TSHRHPGD
SCHEMBL27549948 0.78 BBOX1 (0.40) ZDHHC20ZDHHC2TSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108640861-A \" one kettle way \" that alkynyl amide mediates prepares macrolide 江西师范大学 2018-10-12 CN claimed
CN-108640861-A \" one kettle way \" that alkynyl amide mediates prepares macrolide 江西师范大学 2018-10-12 CN disclosed
CN-105294476-B The synthetic method of 2 acyloxy acrylamides 上海大学 2017-12-19 CN disclosed
CN-105294476-B The synthetic method of 2 acyloxy acrylamides 上海大学 2017-12-19 CN disclosed
CN-106146359-B Mild and efficient preparation method of alpha-acyloxy alkenyl amide compound and application of alpha-acyloxy alkenyl amide compound in amide and polypeptide synthesis 江西师范大学 2017-11-24 CN disclosed
CN-106146359-A Mild and efficient preparation method of alpha-acyloxy alkenyl amide compound and application of alpha-acyloxy alkenyl amide compound in amide and polypeptide synthesis 江西师范大学 2016-11-23 CN disclosed