SCHEMBL6956345

SCHEMBL6956345

CC(C)(C)OC(=O)ON1CCC(c2ccccn2)C(O)C1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.42
USP30 Q70CQ3 2/20 0.39
RIPK1 Q13546 1/20 0.37
RBP4 P02753 1/20 0.35
GRM5 P41594 1/20 0.35
DPP4 P27487 1/20 0.35
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
BCL2 P10415 1/20 0.34
BECN1 Q14457 1/20 0.34
BTK Q06187 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CASP1 P29466 1/20 0.34
PKM P14618 1/20 0.34
POLB P06746 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
SCHEMBL6955166 0.84 USP30 (0.36) USP30RIPK1DPP4ALDH1A1CASP1
SCHEMBL6950872 0.83 HTT (0.45) GPR119RIPK1
SCHEMBL6956572 0.80 GPR119 (0.42) GPR119RIPK1ALDH1A1
SCHEMBL6955379 0.78 GPR119 (0.34) GPR119USP30
SCHEMBL7081198 0.78 MEN1 (0.41)
SCHEMBL7075359 0.78 MEN1 (0.43)
SCHEMBL6949144 0.78 GPR119 (0.39) GPR119
SCHEMBL5562101 0.78 MEN1 (0.39)
SCHEMBL4602631 0.78 MEN1 (0.39)
SCHEMBL7074937 0.78 MEN1 (0.41) GPR119ALDH1A1PKM

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
EP-0863875-B1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY HOFFMANN LA ROCHE (CH) 2003-06-04 EP disclosed