SCHEMBL695360

SCHEMBL695360

Cc1c(-c2ccccc2)[nH]c2cc[c]cc12

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.48
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
ESR1 P03372 3/20 0.44
ESR2 Q92731 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.41
CYP19A1 P11511 1/20 0.40
KIF11 P52732 3/20 0.39
HTR2A P28223 3/20 0.39
AHR P35869 1/20 0.39
HTR2C P28335 2/20 0.39
KCNH2 Q12809 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
TLR9 Q9NR96 1/20 0.38

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
SCHEMBL694353 0.84 MAPK14 (0.39) CYP11B1CYP11B2HTR2AHTR2C
SCHEMBL694176 0.82 DRD2 (0.43) F2CYP11B1CYP11B2SMN1; SMN2HTR2A
SCHEMBL4280065 0.81 MAOA (0.53) ESR1ESR2CYP19A1HTR2AHTR2C
SCHEMBL694066 0.81 ESR1 (0.46) ESR1ESR2SMN1; SMN2CYP19A1HTR2A
SCHEMBL11331851 0.80 CYP11B1 (0.54) F2CYP11B1CYP11B2ESR1ESR2
SCHEMBL1260425 0.80 CYP11B1 (0.66) F2CYP11B1CYP11B2ESR1ESR2
SCHEMBL11331436 0.78 F2 (0.53) F2CYP11B1CYP11B2ESR1ESR2
SCHEMBL694834 0.77 NR1I2 (0.40) F2CYP11B1CYP11B2MAOAMAOB
SCHEMBL705031 0.76 KIF11 (0.42) KIF11KCNH2TLR9
SCHEMBL314742 0.74 AHR (0.52) SMN1; SMN2AHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2421848-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP claimed
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
WO-2010124119-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO claimed
EP-2421848-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP disclosed
EP-2421825-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP disclosed
WO-2010124108-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO disclosed
WO-2010124119-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO disclosed
EP-2120569-A2 SPIROCHROMANON DERIVATIVES Merck & Co., Inc. (US) 2009-11-25 EP disclosed
WO-2008088692-A2 SPIROCHROMANON DERIVATIVES MERCK & CO., INC. (US) 2008-07-24 WO disclosed