SCHEMBL28945481

SCHEMBL28945481

CCCCc1cc(N)n(CC2CC2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 1/20 0.38
TLR7 Q9NYK1 5/20 0.38
HRH4 Q9H3N8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MPO P05164 1/20 0.34
CNR2 P34972 1/20 0.34
AGTR1 P30556 1/20 0.33
AGTR2 P50052 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
AXL P30530 1/20 0.32
TYRO3 Q06418 1/20 0.32
MERTK Q12866 1/20 0.32
SRC P12931 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
SCHEMBL27821986 0.94 RAB9A (0.42) NOS2TLR7HRH4L3MBTL1MEN1
SCHEMBL27841283 0.94 RAB9A (0.39) NOS2TLR7HRH4L3MBTL1MEN1
SCHEMBL28797205 0.80 L3MBTL1 (0.42) NOS2TLR7HRH4L3MBTL1
SCHEMBL27850705 0.80 L3MBTL1 (0.42) NOS2TLR7HRH4L3MBTL1
SCHEMBL28792136 0.80 NOS2 (0.44) NOS2TLR7HRH4CNR2KCNH2
SCHEMBL27821973 0.78 NOS2 (0.43) NOS2TLR7MPOCNR2
SCHEMBL27836956 0.74 NOS2 (0.40) NOS2TLR7HRH4CNR2ALDH1A1
SCHEMBL7272832 0.73 NOS2 (0.44) NOS2TLR7HRH4CNR2KCNH2
SCHEMBL27854871 0.73 HPGD (0.39) NOS2TLR7HRH4MEN1KMT2A
SCHEMBL4898659 0.71 KDM4E (0.41) L3MBTL1MEN1KMT2AMAPTRAB9A

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
CN-102216277-A Substituted benzamides as cannabinoid receptor ligands ABBOTT LAB 2011-10-12 CN disclosed