SCHEMBL8552592

SCHEMBL8552592

CC(C)COC(=O)N1CCCC(CCCc2ccc3[nH]c(COc4ccc(Cl)cc4)nc3c2OCCCC2CCN(C(=O)OC(C)(C)C)CC2)C1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.39
DGAT2 Q96PD7 1/20 0.38
CHEK2 O96017 2/20 0.37
CYP2C9 P11712 1/20 0.36
PRMT5 O14744 5/20 0.36
NPY1R P25929 1/20 0.34

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
SCHEMBL8555848 0.96 DGAT2 (0.39) GPR119DGAT2CHEK2CYP2C9PRMT5
SCHEMBL8555463 0.93 GPR119 (0.40) GPR119DGAT2CHEK2CYP2C9PRMT5
SCHEMBL8555907 0.87 CHEK2 (0.43) GPR119DGAT2CHEK2CYP2C9PRMT5
SCHEMBL8553086 0.85 GPR119 (0.44) GPR119DGAT2CHEK2PRMT5
SCHEMBL7686453 0.85 DGAT2 (0.44) GPR119DGAT2CHEK2CYP2C9PRMT5
SCHEMBL8557780 0.84 GPR119 (0.44) GPR119DGAT2CHEK2PRMT5NPY1R
SCHEMBL8552642 0.83 DGAT2 (0.41) DGAT2PRMT5
SCHEMBL8556312 0.82 PRMT5 (0.51) GPR119PRMT5NPY1R
SCHEMBL8620953 0.81 DGAT2 (0.41) DGAT2CHEK2NPY1R
SCHEMBL8553734 0.81 GPR119 (0.42) GPR119DGAT2CHEK2PRMT5NPY1R

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