SCHEMBL20764856

SCHEMBL20764856

O=C(O)N1CCC(Oc2cccnn2)CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.45
OGA O60502 1/20 0.43
FAAH O00519 2/20 0.40
NAMPT P43490 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HTT P42858 1/20 0.39
GPR119 Q8TDV5 1/20 0.38
GLS O94925 1/20 0.38
P2RX7 Q99572 1/20 0.38
SCD5 Q86SK9 1/20 0.38
JAK3 P52333 1/20 0.37
SRD5A1 P18405 1/20 0.37

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
SCHEMBL22174175 0.85 JAK3 (0.51) OGAJAK3
SCHEMBL20137665 0.82 GPR119 (0.59) GPR119
SCHEMBL5152829 0.81 EPHX2 (0.63) EPHX2NAMPTGPR119
Hydrochloric Acid SCHEMBL23928369 0.80 EPHX2 (0.62) EPHX2NAMPT
SCHEMBL17869064 0.79 ACSL1 (0.43) OGAFAAH
SCHEMBL17869069 0.79 ACSL1 (0.43) OGAFAAH
SCHEMBL5268383 0.79 GPR119 (0.47) EPHX2NAMPTGPR119GLS
SCHEMBL20070245 0.79 OGA (0.52) OGA
SCHEMBL20958519 0.78 KCNH2 (0.42) FAAHGPR119
SCHEMBL23791265 0.77 PIK3CD (0.52) GPR119

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-3672959-A1 LINEAR GLYCOSIDASE INHIBITORS Asceneuron SA (CH) 2020-07-01 EP disclosed
WO-2019037860-A1 LINEAR GLYCOSIDASE INHIBITORS Asceneuron S.A. (CH) 2019-02-28 WO disclosed