SCHEMBL28570540

SCHEMBL28570540

O=C(Cl)N1C(=O)C=CC1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 1/20 0.37
MGLL Q99685 8/20 0.36
GSK3A P49840 3/20 0.36
GSK3B P49841 3/20 0.36
FAAH O00519 3/20 0.35
PTGS1 P23219 5/20 0.34
PTGS2 P35354 5/20 0.34
DDAH1 O94760 1/20 0.33
NSD2 O96028 1/20 0.33
G6PD P11413 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
ALDH1A1 P00352 3/20 0.32
BLM P54132 3/20 0.32
HPGD P15428 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
WRN Q14191 1/20 0.32
HIF1A Q16665 1/20 0.32
NPSR1 Q6W5P4 2/20 0.32

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
SCHEMBL10586150 0.79 MGLL (0.38) MGLLGSK3AGSK3BFAAHPTGS1
SCHEMBL711961 0.75 NSD2 (0.41) MGLLGSK3AGSK3BFAAHPTGS1
SCHEMBL10516220 0.74 MGLL (0.35) MGLLGSK3AGSK3BFAAHALDH1A1
SCHEMBL317849 0.73 DDAH1 (0.39) MGLLGSK3AGSK3BFAAHPTGS1
SCHEMBL2801370 0.71 LMNA (0.43) P2RX4MGLLGSK3AGSK3BFAAH
SCHEMBL720720 0.71 MGLL (0.43) MGLLGSK3AGSK3BFAAHDDAH1
SCHEMBL15301140 0.69 TDP1 (0.32) MGLLGSK3AGSK3BALDH1A1HPGD
SCHEMBL4761585 0.67 MGLL (0.35) MGLLGSK3AGSK3BFAAHPTGS1
SCHEMBL284850 0.67 MGLL (0.33) MGLLGSK3AGSK3BFAAHDDAH1
SCHEMBL8607093 0.65 MGLL (0.39) MGLLGSK3AGSK3BFAAHPTGS1

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-112898561-A Maleimide-terminated polyphenylene ether and preparation method thereof 大连理工大学 2021-06-04 CN claimed
CN-112898561-A Maleimide-terminated polyphenylene ether and preparation method thereof 大连理工大学 2021-06-04 CN disclosed