SCHEMBL28797205

SCHEMBL28797205

CCCCc1cc(N)n(CC2CC[C@H](C)O2)n1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
TLR7 Q9NYK1 3/20 0.34
NOS2 P35228 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
PDE8B O95263 1/20 0.33
CTSD P07339 2/20 0.31
CCNT1 O60563 1/20 0.31
CDK7 P50613 1/20 0.31
CDK9 P50750 1/20 0.31
CCNH P51946 1/20 0.31
MAOA P21397 1/20 0.30

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
SCHEMBL27850705 1.00 L3MBTL1 (0.42) L3MBTL1TLR7NOS2HRH4PDE8B
SCHEMBL28945481 0.80 NOS2 (0.38) L3MBTL1TLR7NOS2HRH4
SCHEMBL27841283 0.78 RAB9A (0.39) L3MBTL1TLR7NOS2HRH4
SCHEMBL27821986 0.78 RAB9A (0.42) L3MBTL1TLR7NOS2HRH4
SCHEMBL478430 0.76 KDM4E (0.35)
SCHEMBL28792136 0.73 NOS2 (0.44) TLR7NOS2HRH4
SCHEMBL27821973 0.72 NOS2 (0.43) TLR7NOS2
SCHEMBL27836956 0.68 NOS2 (0.40) TLR7NOS2HRH4
SCHEMBL7272832 0.67 NOS2 (0.44) TLR7NOS2HRH4
SCHEMBL27854871 0.67 HPGD (0.39) TLR7NOS2HRH4

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-102448957-A Compounds as cannabinoid receptor ligands ABBOTT LAB 2012-05-09 CN disclosed