SCHEMBL7586183

SCHEMBL7586183

C=CC(O)C1CCNCC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPN1 P15169 1/20 0.35
CPB2 Q96IY4 1/20 0.35
GABRA1 P14867 2/20 0.31
TSHR P16473 2/20 0.31
GABRG2 P18507 2/20 0.31
GABRB3 P28472 2/20 0.31
GABRA5 P31644 2/20 0.31
GABRA3 P34903 2/20 0.31
GABRA2 P47869 2/20 0.31
GABRA6 Q16445 2/20 0.31
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRB2 P47870 1/20 0.31
GABRA4 P48169 1/20 0.31
GABRE P78334 1/20 0.31
PMP22 Q01453 1/20 0.31
GABRG1 Q8N1C3 1/20 0.31
GABRG3 Q99928 1/20 0.31
GABRQ Q9UN88 1/20 0.31

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
SCHEMBL1471843 0.82
SCHEMBL8764246 0.82 UGT2B7 (0.32)
SCHEMBL130488 0.82
SCHEMBL1464686 0.77
SCHEMBL2511775 0.75 TP53 (0.41) PMP22LMNA
SCHEMBL10524293 0.75 TP53 (0.41) PMP22LMNA
SCHEMBL4253818 0.72
SCHEMBL7802318 0.72 UGT2B7 (0.31)
SCHEMBL6112257 0.71
SCHEMBL728989 0.71 CPN1 (0.31) CPN1CPB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1215215-A1 Platelet aggregation inhibitors containing c-terminal aminergic side chain amino acid residues G.D. SEARLE & CO. (US) 2002-06-19 EP disclosed
US-5811398-A Platelet aggregation inhibitors containing C-terminal aminergic side chain amino acid residues G. D. SEARLE & CO. (US) 1998-09-22 US disclosed
EP-0835265-A1 PLATELET AGGREGATION INHIBITORS CONTAINING C-TERMINAL AMINERGIC SIDE CHAIN AMINO ACID RESIDUES G.D. SEARLE & CO. (US) 1998-04-15 EP disclosed
WO-1996032415-A1 PLATELET AGGREGATION INHIBITORS CONTAINING C-TERMINAL AMINERGIC SIDE CHAIN AMINO ACID RESIDUES G.D. SEARLE & CO. (US) 1996-10-17 WO disclosed
EP-0577217-A1 Tetrazolyl-(phenoxy and phenoxyalkyl) piperidininylpyridazines as antiviral agents STERLING WINTHROP INC. (US) 1994-01-05 EP disclosed
US-5268351-A Containing a perhydro(iso)quinoline ring structure BASF AKTIENGESELLSCHAFT (DE) 1993-12-07 US disclosed
US-5242924-A Tetrazolyl-(phenoxy and phenoxyalkyl)-piperidinylpyridazines as antiviral agents STERLING WINTHROP INC. (US) 1993-09-07 US disclosed
US-5175295-A Mildewicides BASF AKTIENGESELLSCHAFT (DE) 1992-12-29 US disclosed