SCHEMBL4781869

SCHEMBL4781869

CC(C)(C)OC(=O)N1CCCC[C@H]1[C@@H](O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 5/20 0.43
UCHL1 P09936 1/20 0.43
GPR119 Q8TDV5 1/20 0.40
KLK7 P49862 1/20 0.40
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
PTPN6 P29350 1/20 0.40
NR1H2 P55055 3/20 0.39
RXRA P19793 2/20 0.39
NR1H3 Q13133 2/20 0.39
HSD17B2 P37059 1/20 0.39
KDM1A O60341 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
SCHEMBL3443002 0.93 GPR119 (0.43) UCHL1GPR119KLK7KDM1A
SCHEMBL1795627 0.93 GPR119 (0.43) UCHL1GPR119KLK7KDM1A
SCHEMBL25969334 0.93 GPR119 (0.43) UCHL1GPR119KLK7KDM1A
SCHEMBL3538308 0.92 GPR119 (0.43) UCHL1GPR119KLK7KDM1A
SCHEMBL28194949 0.89 KLK7 (0.45) UCHL1GPR119KLK7
SCHEMBL29997863 0.89 KLK7 (0.45) UCHL1GPR119KLK7
SCHEMBL1843454 0.89 KLK7 (0.45) UCHL1GPR119KLK7
SCHEMBL13997813 0.89 KLK7 (0.45) UCHL1GPR119KLK7
SCHEMBL8224323 0.89 GPR119 (0.51) GPR119KDM1A
SCHEMBL14453328 0.84 GPR119 (0.44) UCHL1GPR119KLK7NR1H2NR1H3

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
WO-2008018639-A2 GLYCINE TRANSPORTER INHIBITOR TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-02-14 WO disclosed
WO-2008018639-A2 GLYCINE TRANSPORTER INHIBITOR TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-02-14 WO disclosed