SCHEMBL8553086

SCHEMBL8553086

CC(C)(C)OC(=O)N1CCC(CCCc2ccc3[nH]c(COc4ccc(Cl)cc4)nc3c2OCCCBr)CC1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.44
CHEK2 O96017 2/20 0.41
PRMT5 O14744 4/20 0.41
FAAH O00519 1/20 0.38
DGAT2 Q96PD7 1/20 0.38

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
SCHEMBL8557780 0.91 GPR119 (0.44) GPR119CHEK2PRMT5FAAHDGAT2
SCHEMBL8556312 0.89 PRMT5 (0.51) GPR119PRMT5
SCHEMBL8553734 0.89 GPR119 (0.42) GPR119CHEK2PRMT5FAAHDGAT2
SCHEMBL8555211 0.88 GPR119 (0.45) GPR119CHEK2PRMT5FAAHDGAT2
SCHEMBL8555463 0.86 GPR119 (0.40) GPR119CHEK2PRMT5DGAT2
SCHEMBL8551336 0.86 GPR119 (0.47) GPR119CHEK2PRMT5FAAHDGAT2
Trifluoroacetic Acid SCHEMBL8552693 0.86 CHEK2 (0.40) GPR119CHEK2PRMT5DGAT2
Trifluoroacetic Acid SCHEMBL8552332 0.86 PRMT5 (0.40) GPR119CHEK2PRMT5DGAT2
Trifluoroacetic Acid SCHEMBL8555305 0.86 PRMT5 (0.40) GPR119CHEK2PRMT5DGAT2
SCHEMBL8552756 0.85 GPR119 (0.45) GPR119CHEK2PRMT5FAAHDGAT2

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