SCHEMBL4063905

SCHEMBL4063905

O=C1CCCN1C1CCCC(Cc2ccc(Br)cc2OC(F)(F)F)C1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.37
MCHR1 Q99705 9/20 0.35
ADRA2A P08913 6/20 0.35
KCNH2 Q12809 1/20 0.34
NPY5R Q15761 3/20 0.33
OPRM1 P35372 1/20 0.32
DDR1 Q08345 2/20 0.32
TACR1 P25103 1/20 0.31
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31
SLC6A4 P31645 1/20 0.31

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
SCHEMBL4069187 0.85 CCRL2 (0.33) DDR1TACR1
SCHEMBL5500736 0.81 KMT2A (0.35) OPRM1
SCHEMBL5499828 0.79 DPP4 (0.38) OPRM1
SCHEMBL5503146 0.74 HTR2C (0.38) OPRM1SLC6A4
SCHEMBL210897 0.74 HSD11B1 (0.49) EPHX2MCHR1ADRA2ANPY5ROPRM1
SCHEMBL5506343 0.73 P2RX7 (0.46) NPY5R
SCHEMBL5241644 0.72 NPY5R (0.34) KCNH2NPY5RHCRTR1HCRTR2
SCHEMBL5508747 0.70 CHRNB2 (0.40) HCRTR1HCRTR2
SCHEMBL5503413 0.70 DPP4 (0.36) KCNH2OPRM1
SCHEMBL5503988 0.70 P2RX7 (0.45) EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101541747-B Biphenyl amide lactam derivatives as inhibitors of 11- beta-hydroxysteroid dehydrogenase 1 LILLY CO ELI 2012-11-14 CN disclosed
CN-101541747-A Biphenyl amide lactam derivatives as inhibitors of 11- beta-hydroxysteroid dehydrogenase 1 LILLY CO ELI (US) 2009-09-23 CN disclosed
EP-2016047-A1 BIPHENYL AMIDE LACTAM DERIVATIVES AS INHIBITORS OF 11- BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2009-01-21 EP disclosed
WO-2007124337-A1 BIPHENYL AMIDE LACTAM DERIVATIVES AS INHIBITORS OF 11- BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-11-01 WO disclosed