SCHEMBL462923

SCHEMBL462923

CC(C)c1noc(C(=O)N2CCC(COS(C)(=O)=O)CC2)n1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.40
GPR183 P32249 1/20 0.39
CHRM4 P08173 1/20 0.35
EPHX2 P34913 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TNF P01375 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
NOD1 Q9Y239 1/20 0.33
KCNH2 Q12809 1/20 0.32
MCHR1 Q99705 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TSHR P16473 1/20 0.32
ABCB1 P08183 1/20 0.31
ABCC1 P33527 1/20 0.31
ABCG2 Q9UNQ0 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
SCHEMBL461048 0.82 HTR2C (0.41) GPR119CHRM4EPHX2SMN1; SMN2
SCHEMBL388551 0.79 GPR119 (0.59) GPR119GPR183KCNH2
SCHEMBL470574 0.72 GPR119 (0.45) GPR119GPR183KCNH2ABCB1ABCC1
SCHEMBL462444 0.70 GPR119 (0.39) GPR119GPR183KCNH2
SCHEMBL3321087 0.69 F10 (0.40) GPR119EPHX2MAPT
SCHEMBL3533847 0.69 ALDH1A1 (0.35) GPR119
SCHEMBL384560 0.69 GPR119 (0.55) GPR119
SCHEMBL148647 0.69 GPR119 (0.55) GPR119GPR183KCNH2
SCHEMBL8549864 0.69 ACHE (0.56) SMN1; SMN2
SCHEMBL20323516 0.69 MAPT (0.48) GPR119MAPTSMN1; SMN2TSHR

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
WO-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 WO disclosed