SCHEMBL703221

SCHEMBL703221

Cc1cc2cccc(-c3cccc(F)c3)c2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
TNKS2 Q9H2K2 1/20 0.39
PGR P06401 2/20 0.38
ADORA3 P0DMS8 1/20 0.37
ACHE P22303 1/20 0.37
NR3C1 P04150 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
MAPK13 O15264 1/20 0.37
RAF1 P04049 1/20 0.37
MAPK12 P53778 1/20 0.37
MAPK11 Q15759 1/20 0.37
MAPK14 Q16539 1/20 0.37
NPY5R Q15761 1/20 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
SCHEMBL15450902 0.85 MAPK14 (0.49) MGAMGAASIMGAM2TNKS2
SCHEMBL694766 0.83 MGAM (0.40) MGAMGAASIMGAM2TNKS2
SCHEMBL11719410 0.83 KDM4E (0.42) GAAPGRADORA3NR3C1KDM4E
SCHEMBL15450952 0.77 GAA (0.42) MGAMGAASIMGAM2TNKS2
SCHEMBL30494338 0.76 HPGD (0.50) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL29053573 0.76 HPGD (0.50) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL18000204 0.75 MAPK14 (0.49) MGAMGAASIMGAM2MAPK11
SCHEMBL15451004 0.75 CDK4 (0.47) MGAMGAASIMGAM2PGR
SCHEMBL13469323 0.75 ADORA3 (0.44) MGAMGAASIMGAM2ADORA3
SCHEMBL3293424 0.73 DAO (0.53) GAAACHEKDM4EALDH1A1MAPT

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-2421825-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP claimed
WO-2010124108-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO claimed