SCHEMBL5503441

SCHEMBL5503441

O=C1CCCN1C1CCC(O)C(Cc2c(Cl)cc(C(F)(F)F)cc2Cl)C1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 5/20 0.36
TACR2 P21452 3/20 0.36
TACR3 P29371 1/20 0.36
CCRL2 O00421 2/20 0.35
ENPP2 Q13822 1/20 0.33
DDR1 Q08345 2/20 0.33
CTSS P25774 1/20 0.33
F10 P00742 1/20 0.33
RORC P51449 2/20 0.32
HTR7 P34969 1/20 0.32
NPY5R Q15761 1/20 0.32
POLB P06746 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
SCHEMBL5504560 0.84 BTK (0.38) POLB
SCHEMBL5500218 0.83 MMP13 (0.38) F10
SCHEMBL5501184 0.81 NPY5R (0.35) CTSSF10NPY5R
SCHEMBL5501783 0.79 LMNA (0.43) RORCPOLB
SCHEMBL5502942 0.79 LMNA (0.38) POLB
SCHEMBL5509855 0.78 CYP11B2 (0.39) NPY5R
SCHEMBL5507807 0.78 HRH3 (0.39)
SCHEMBL5500031 0.77 P2RX7 (0.44) F10
SCHEMBL5500067 0.75 KMT2A (0.36) F10
SCHEMBL5499710 0.75 HCRTR1 (0.37) POLB

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-1807072-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-07-18 EP disclosed
WO-2006049952-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2006-05-11 WO disclosed