SCHEMBL9347148

SCHEMBL9347148

CC(=O)N(C)C(C)C1CCNCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPN1 P15169 1/20 0.38
CPB2 Q96IY4 1/20 0.38
ALOX5 P09917 1/20 0.37
SLC6A2 P23975 3/20 0.36
SLC6A4 P31645 3/20 0.36
SLC6A3 Q01959 3/20 0.36
OPRD1 P41143 1/20 0.35
GABRP O00591 1/20 0.34
GABRD O14764 1/20 0.34
GABRA1 P14867 1/20 0.34
TSHR P16473 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
GABRA2 P47869 1/20 0.34
GABRB2 P47870 1/20 0.34
GABRA4 P48169 1/20 0.34
GABRE P78334 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
SCHEMBL3941287 0.83 CPN1 (0.37) CPN1CPB2ALOX5SLC6A2SLC6A4
Hydrochloric Acid SCHEMBL22797887 0.77 SLC6A2 (0.36) CPN1CPB2ALOX5SLC6A2SLC6A4
SCHEMBL18361920 0.77 CPN1 (0.39) CPN1CPB2SLC6A2SLC6A4SLC6A3
SCHEMBL19668002 0.76 ALOX5 (0.39) CPN1CPB2ALOX5SLC6A2SLC6A4
SCHEMBL18081016 0.74 SLC6A2 (0.35) CPN1CPB2ALOX5SLC6A2SLC6A4
SCHEMBL528681 0.74 SLC6A2 (0.35) CPN1CPB2ALOX5SLC6A2SLC6A4
SCHEMBL27261240 0.74 OPRD1 (0.54) SLC6A2SLC6A4SLC6A3OPRD1
Acetamide SCHEMBL21873301 0.69 CPN1 (0.41) CPN1CPB2ALOX5SLC6A2SLC6A4
SCHEMBL22295980 0.69 CPN1 (0.41) CPN1CPB2SLC6A2SLC6A4SLC6A3
Acetic Acid SCHEMBL387357 0.69 CPN1 (0.46) CPN1CPB2SLC6A2SLC6A4SLC6A3

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
US-5338738-A Cerebral function enhancers: acyclic amide derivatives of pyrimidinylpiperidines BRISTOL-MYERS SQUIBB COMPANY (US) 1994-08-16 US disclosed