SCHEMBL8551675

SCHEMBL8551675

COC(=O)c1cc(CCCC2CCN(C(=O)OC(C)(C)C)CC2)c2nc(COc3ccc(Cl)cc3)[nH]c2c1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 3/20 0.44
GPR119 Q8TDV5 8/20 0.43
PRMT5 O14744 3/20 0.41
YAP1 P46937 2/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
FAAH O00519 1/20 0.39

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
SCHEMBL8555610 0.86 NPY1R (0.42) CHEK2
SCHEMBL8557780 0.84 GPR119 (0.44) CHEK2GPR119PRMT5FAAH
SCHEMBL8555211 0.84 GPR119 (0.45) CHEK2GPR119PRMT5FAAH
SCHEMBL8551336 0.82 GPR119 (0.47) CHEK2GPR119PRMT5FAAH
SCHEMBL8552756 0.82 GPR119 (0.45) CHEK2GPR119PRMT5FAAH
SCHEMBL8552821 0.81 GPR119 (0.42) CHEK2GPR119PRMT5FAAH
SCHEMBL8553734 0.81 GPR119 (0.42) CHEK2GPR119PRMT5FAAH
SCHEMBL8553086 0.81 GPR119 (0.44) CHEK2GPR119PRMT5FAAH
SCHEMBL8556312 0.80 PRMT5 (0.51) GPR119PRMT5YAP1
SCHEMBL8554479 0.78 NPY1R (0.45) PRMT5MAPTFAAH

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