SCHEMBL5884362

SCHEMBL5884362

CON=Cc1ccc(OCCC2CCN(c3ccc(C)nn3)CC2)cc1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.38
GAA P10253 1/20 0.37
GPR119 Q8TDV5 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
TEAD1 P28347 1/20 0.34
TEAD3 Q99594 1/20 0.34
HPGD P15428 5/20 0.34
MAPT P10636 1/20 0.34
NFE2L2 Q16236 1/20 0.33
ACACB O00763 1/20 0.33
MAOB P27338 1/20 0.33

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
SCHEMBL5884356 0.95 HRH3 (0.38) NR1I2GAAGPR119L3MBTL1HPGD
SCHEMBL14191686 0.92 NR1I2 (0.38) NR1I2GPR119L3MBTL1TEAD1TEAD3
SCHEMBL5884133 0.90 NR1I2 (0.36) NR1I2GPR119L3MBTL1TEAD1TEAD3
SCHEMBL5884333 0.90 KCNH2 (0.39) NR1I2GAAGPR119L3MBTL1TEAD1
SCHEMBL5884268 0.90 MEN1 (0.43) GPR119
SCHEMBL5884689 0.90 KCNH2 (0.39) NR1I2GAAGPR119L3MBTL1TEAD1
SCHEMBL5884287 0.89 L3MBTL1 (0.37) NR1I2GAAGPR119L3MBTL1TEAD1
SCHEMBL5884326 0.88 NPC1 (0.38) GPR119TEAD1TEAD3
SCHEMBL5884829 0.88 L3MBTL1 (0.36) NR1I2GPR119L3MBTL1TEAD1TEAD3
SCHEMBL5884227 0.87 NR1I2 (0.35) NR1I2GPR119L3MBTL1TEAD1TEAD3

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