SCHEMBL7464383

SCHEMBL7464383

CC(C)(C)OC(=O)N(C[C@@H]1CCNC1)C1CC1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A1 P30531 2/20 0.39
GABRA5 P31644 2/20 0.39
GABRB2 P47870 2/20 0.39
SLC6A12 P48065 2/20 0.39
SLC6A11 P48066 2/20 0.39
SLC6A13 Q9NSD5 2/20 0.39
GABRA1 P14867 1/20 0.39
GABRR1 P24046 1/20 0.39
GABRA4 P48169 1/20 0.39
SLC6A4 P31645 15/20 0.37
SLC6A2 P23975 14/20 0.37
SLC6A3 Q01959 11/20 0.37
USP30 Q70CQ3 1/20 0.36
REN P00797 1/20 0.34
CYP2D6 P10635 4/20 0.34
KCNH2 Q12809 1/20 0.34
CHRM4 P08173 1/20 0.34
CYP3A4 P08684 1/20 0.34
CHRM5 P08912 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
SCHEMBL19817011 1.00 SLC6A1 (0.39) SLC6A1GABRA5GABRB2SLC6A12SLC6A11
SCHEMBL25105583 0.96 SLC6A2 (0.41) SLC6A1GABRA5GABRB2SLC6A12SLC6A11
SCHEMBL1496060 0.91 SLC6A2 (0.36) SLC6A4SLC6A2SLC6A3RENCYP2D6
SCHEMBL31211305 0.90 REN (0.38) SLC6A4SLC6A2SLC6A3REN
SCHEMBL25105977 0.86 SLC6A2 (0.48) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2
SCHEMBL25105353 0.86 SLC6A2 (0.48) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2
SCHEMBL25260214 0.86 SLC6A2 (0.48) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2
SCHEMBL1958503 0.85 SLC6A2 (0.39) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2
SCHEMBL15363207 0.82 USP30 (0.45) SLC6A1GABRA5GABRB2SLC6A12SLC6A11
SCHEMBL3699616 0.82 USP30 (0.45) SLC6A1GABRA5GABRB2SLC6A12SLC6A11

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1116295-C Cycloalkylaminomethylpyrrolidine derivatives DAIICHI SEIYAKU CO (JP) 2003-07-30 CN disclosed
EP-0900793-B1 CYCLOALKYLAMINOMETHYLPYRROLIDINE DERIVATIVES DAIICHI SEIYAKU CO (JP) 2002-07-24 EP disclosed
US-6194434-B1 MICROBIOCIDES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-02-27 US disclosed
CN-1222151-A Cycloalkylaminomethylpyrrolidine derivatives DAIICHI SEIYAKU CO (JP) 1999-07-07 CN disclosed
EP-0900793-A1 CYCLOALKYLAMINOMETHYLPYRROLIDINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-03-10 EP disclosed