SCHEMBL4010140

SCHEMBL4010140

Cn1nc(C(C)(C)C)cc1NC(=O)C(C)(C)S(=O)(=O)C[C@@H]1CCC(=O)N1.Cn1nc(C(C)(C)C)cc1NC(=O)C(C)(C)S(=O)(=O)C[C@H]1CCC(=O)N1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.49
MAPK14 Q16539 12/20 0.39
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
MAPK11 Q15759 2/20 0.38
MAPK13 O15264 1/20 0.38
MAPK12 P53778 1/20 0.38
KDM1A O60341 1/20 0.37
ERBB2 P04626 1/20 0.37
NTRK1 P04629 1/20 0.36
NAA50 Q9GZZ1 3/20 0.36

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
SCHEMBL1621119 1.00 CNR2 (0.49) CNR2MAPK14MAPTLMNAMAPK11
SCHEMBL4010142 1.00 CNR2 (0.49) CNR2MAPK14MAPTLMNAMAPK11
SCHEMBL1621107 1.00 CNR2 (0.49) CNR2MAPK14MAPTLMNAMAPK11
SCHEMBL1621111 1.00 CNR2 (0.49) CNR2MAPK14MAPTLMNAMAPK11
SCHEMBL4172770 0.84 CNR2 (0.46) CNR2MAPK14
SCHEMBL4172767 0.84 CNR2 (0.46) CNR2MAPK14
SCHEMBL1620468 0.81 CNR2 (0.55) CNR2MAPK14MAPTLMNAMAPK11
SCHEMBL1621201 0.81 CNR2 (0.41) CNR2MAPK14MAPTLMNAMAPK11
SCHEMBL1621251 0.81 CNR2 (0.41) CNR2MAPK14MAPTLMNAMAPK11
SCHEMBL1621203 0.81 CNR2 (0.41) CNR2MAPK14MAPTLMNAMAPK11

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2074084-A1 COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR Boehringer Ingelheim International GmbH (DE) 2009-07-01 EP disclosed
WO-2008039645-A1 COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-04-03 WO disclosed