SCHEMBL5884356

SCHEMBL5884356

CON=Cc1ccc(OCCCC2CCN(c3ccc(C)nn3)CC2)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.38
NR1I2 O75469 1/20 0.37
GPR119 Q8TDV5 4/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.35
HPGD P15428 2/20 0.34
DRD2 P14416 1/20 0.32
DRD1 P21728 1/20 0.32
DRD5 P21918 1/20 0.32
DRD3 P35462 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ACHE P22303 1/20 0.32
PTGES O14684 1/20 0.32

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
SCHEMBL5884362 0.95 NR1I2 (0.38) NR1I2GPR119L3MBTL1GAAMAPT
SCHEMBL5884353 0.90 KCNH2 (0.39) HRH3NR1I2GPR119L3MBTL1MAPT
SCHEMBL5884759 0.90 MEN1 (0.43) HRH3L3MBTL1MAPT
SCHEMBL5884348 0.88 MAPT (0.37) HRH3GPR119L3MBTL1MAPT
SCHEMBL5884729 0.88 NPC1 (0.37) L3MBTL1KDM4EACHE
SCHEMBL5884514 0.88 NR1I2 (0.35) HRH3NR1I2GPR119L3MBTL1MAPT
SCHEMBL14191686 0.87 NR1I2 (0.38) NR1I2GPR119L3MBTL1MAPTHPGD
SCHEMBL5884512 0.86 NPY1R (0.37) HRH3GPR119L3MBTL1GAAMAPT
SCHEMBL5884133 0.85 NR1I2 (0.36) NR1I2GPR119L3MBTL1MAPTHPGD
SCHEMBL5884689 0.85 KCNH2 (0.39) NR1I2GPR119L3MBTL1GAAMAPT

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-7078403-B1 Antiviral agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD. (AU) 2006-07-18 US claimed