SCHEMBL4035873

SCHEMBL4035873

CCC(N)c1cccc(-c2ccccc2)c1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.42
CHRNA4 P43681 1/20 0.42
MAOA P21397 1/20 0.42
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
LMNA P02545 1/20 0.41
SLC6A4 P31645 1/20 0.40
CYP17A1 P05093 1/20 0.40
AGXT P21549 1/20 0.39
PTPN5 P54829 1/20 0.39
SCN4A P35499 2/20 0.39
ANPEP P15144 1/20 0.39
ENPEP Q07075 1/20 0.39
CFD P00746 1/20 0.39
F11 P03951 1/20 0.39
TPSB2 P20231 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
SCHEMBL12261662 1.00 CHRNB2 (0.42) CHRNB2CHRNA4MAOARXRARXRB
SCHEMBL13701300 0.87 SLC6A4 (0.39) RXRARXRBRXRGSLC6A4CYP17A1
SCHEMBL5712566 0.83 SLC6A4 (0.48) LMNASLC6A4SCN4AANPEPENPEP
SCHEMBL11296454 0.82 SLC6A4 (0.53) CHRNB2CHRNA4LMNASLC6A4CYP17A1
SCHEMBL170928 0.81 SLC6A4 (0.56) LMNASLC6A4SCN4A
SCHEMBL176808 0.81 SLC6A4 (0.56) LMNASLC6A4SCN4A
Benzene SCHEMBL28170835 0.81 SLC6A4 (0.56) LMNASLC6A4SCN4A
SCHEMBL43945 0.81 SLC6A4 (0.56) LMNASLC6A4SCN4A
SCHEMBL29503095 0.81 SLC6A4 (0.56) LMNASLC6A4SCN4A
SCHEMBL3159983 0.79 TAAR1 (0.48) CHRNB2CHRNA4MAOASLC6A4AGXT

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-1509497-A1 CALCIUM RECEPTOR MODULATING ARYLALKYLAMINES Amgen Inc. (US) 2005-03-02 EP claimed
WO-2003099776-A1 CALCIUM RECEPTOR MODULATING ARYLALKYLAMINES AMGEN INC. (US) 2003-12-04 WO claimed
EP-2010150-A2 STABLE EMULSION FORMULATIONS Amgen Inc. (US) 2009-01-07 EP disclosed
WO-2007124465-A2 STABLE EMULSION FORMULATIONS AMGEN INC. (US) 2007-11-01 WO disclosed
EP-1509497-A1 CALCIUM RECEPTOR MODULATING ARYLALKYLAMINES Amgen Inc. (US) 2005-03-02 EP disclosed
WO-2003099776-A1 CALCIUM RECEPTOR MODULATING ARYLALKYLAMINES AMGEN INC. (US) 2003-12-04 WO disclosed
US-6124305-A TREATING NON-INSULIN DEPENDENT DIABETES MELLITUS NOVARTIS AG (CH) 2000-09-26 US disclosed
US-6011155-A N-(substituted glycyl)-2-cyanopyrrolidines, pharmaceutical compositions containing them and their use in inhibiting dipeptidyl peptidase-IV NOVARTIS AG (CH) 2000-01-04 US disclosed