SCHEMBL5884481

SCHEMBL5884481

CCON=Cc1ccc(OCCC2CCN(c3cccc(C)n3)CC2)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSS P25774 2/20 0.39
PDE10A Q9Y233 1/20 0.38
KCNH2 Q12809 2/20 0.37
HTR3A P46098 2/20 0.37
HTR3E A5X5Y0 1/20 0.37
HTR3B O95264 1/20 0.37
HTR3D Q70Z44 1/20 0.37
HTR3C Q8WXA8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ACACB O00763 2/20 0.36
KMT2A Q03164 3/20 0.35
MAPT P10636 2/20 0.35
MEN1 O00255 2/20 0.35
GAA P10253 1/20 0.35
POLB P06746 1/20 0.35
TEAD1 P28347 1/20 0.34
TEAD3 Q99594 1/20 0.34
GPR119 Q8TDV5 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
SCHEMBL5884333 0.86 KCNH2 (0.39) KCNH2L3MBTL1KMT2AMAPTMEN1
SCHEMBL5884689 0.86 KCNH2 (0.39) KCNH2L3MBTL1KMT2AMAPTMEN1
SCHEMBL5884766 0.85 NPY1R (0.41) KCNH2L3MBTL1KMT2AMAPTMEN1
SCHEMBL5884353 0.82 KCNH2 (0.39) KCNH2L3MBTL1KMT2AMAPTMEN1
SCHEMBL5884003 0.81 KCNH2 (0.38) KCNH2L3MBTL1KMT2AMAPTMEN1
SCHEMBL5883827 0.81 KMT2A (0.40) KCNH2L3MBTL1KMT2AMAPTMEN1
SCHEMBL5884253 0.81 KMT2A (0.40) KCNH2L3MBTL1KMT2AMAPTMEN1
SCHEMBL5885023 0.81 KCNH2 (0.37) KCNH2L3MBTL1KMT2AMAPTPOLB
SCHEMBL5884674 0.81 GPR119 (0.38) KCNH2L3MBTL1ACACBKMT2AMAPT
SCHEMBL14191686 0.80 NR1I2 (0.38) KCNH2L3MBTL1ACACBKMT2AMAPT

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