SCHEMBL8555848

SCHEMBL8555848

CC(C)COC(=O)N1CCCC(CCCc2ccc3[nH]c(COc4ccc(Cl)cc4)nc3c2OCCC2CCCN(C(=O)OC(C)(C)C)C2)C1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DGAT2 Q96PD7 2/20 0.39
CHEK2 O96017 2/20 0.38
CYP2C9 P11712 1/20 0.37
PRMT5 O14744 3/20 0.37
FNTA P49354 1/20 0.34
FNTB P49356 1/20 0.34
GPR119 Q8TDV5 6/20 0.34
HTR6 P50406 2/20 0.34
BCHE P06276 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33

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
SCHEMBL8552592 0.96 GPR119 (0.39) DGAT2CHEK2CYP2C9PRMT5GPR119
SCHEMBL8555463 0.89 GPR119 (0.40) DGAT2CHEK2CYP2C9PRMT5GPR119
SCHEMBL8555907 0.88 CHEK2 (0.43) DGAT2CHEK2CYP2C9PRMT5FNTA
SCHEMBL7686453 0.86 DGAT2 (0.44) DGAT2CHEK2CYP2C9PRMT5FNTA
SCHEMBL8552642 0.84 DGAT2 (0.41) DGAT2PRMT5
SCHEMBL8620953 0.82 DGAT2 (0.41) DGAT2CHEK2
SCHEMBL8553086 0.82 GPR119 (0.44) DGAT2CHEK2PRMT5GPR119
SCHEMBL8556963 0.81 DGAT2 (0.41) DGAT2PRMT5BCHE
SCHEMBL8557780 0.81 GPR119 (0.44) DGAT2CHEK2PRMT5GPR119
SCHEMBL8551796 0.80 DGAT2 (0.42) DGAT2CHEK2

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
EP-0871442-A1 BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1998-10-21 EP disclosed
WO-1997025041-A1 BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1997-07-17 WO disclosed