SCHEMBL4762907

SCHEMBL4762907

CC(C)(C)OC(=O)N1CCCC1N(c1ccc(Cl)c(Cl)c1)c1nccs1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 6/20 0.39
UCHL1 P09936 3/20 0.39
OPRK1 P41145 2/20 0.39
ALDH1A1 P00352 2/20 0.39
TSHR P16473 4/20 0.38
LMNA P02545 4/20 0.38
NPSR1 Q6W5P4 2/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
GPR119 Q8TDV5 1/20 0.38
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
GRM5 P41594 2/20 0.35
UTS2R Q9UKP6 1/20 0.35

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
SCHEMBL4762905 1.00 USP30 (0.39) USP30UCHL1OPRK1ALDH1A1TSHR
SCHEMBL330250 0.82 GPR119 (0.47) USP30MEN1KMT2AGPR119
SCHEMBL330251 0.82 GPR119 (0.47) USP30MEN1KMT2AGPR119
SCHEMBL4791424 0.82 TSHR (0.43) USP30UCHL1OPRK1ALDH1A1TSHR
SCHEMBL4791421 0.82 TSHR (0.43) USP30UCHL1OPRK1ALDH1A1TSHR
SCHEMBL4764260 0.73 CYP3A4 (0.43) USP30ALDH1A1TSHRLMNANPSR1
SCHEMBL4762740 0.73 ALDH1A1 (0.42) USP30UCHL1OPRK1ALDH1A1TSHR
SCHEMBL4762739 0.73 ALDH1A1 (0.42) USP30UCHL1OPRK1ALDH1A1TSHR
SCHEMBL4771659 0.72 ALDH1A1 (0.42) USP30OPRK1ALDH1A1TSHRLMNA
SCHEMBL4771661 0.72 ALDH1A1 (0.42) USP30OPRK1ALDH1A1TSHRLMNA

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-1881975-A1 N,N-SUBSTITUTED 3-AMINOPYRROLIDINE COMPOUNDS USEFUL AS MONOAMINES REUPTAKE INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-01-30 EP disclosed
WO-2006121218-A1 N,N-SUBSTITUTED 3-AMINOPYRROLIDINE COMPOUNDS USEFUL AS MONOAMINES REUPTAKE INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-11-16 WO disclosed