SCHEMBL5504560

SCHEMBL5504560

O=C1CCCN1C1CCC(O)C(Cc2c(Cl)cccc2Cl)C1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.38
DPP4 P27487 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP9 Q86TI2 1/20 0.38
LMNA P02545 1/20 0.35
POLB P06746 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
P2RX7 Q99572 3/20 0.35
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
OPRL1 P41146 2/20 0.34
SIGMAR1 Q99720 1/20 0.33
LTA4H P09960 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL5502942 0.94 LMNA (0.38) BTKDPP4DPP8DPP9LMNA
SCHEMBL5501783 0.92 LMNA (0.43) BTKDPP4DPP8DPP9LMNA
SCHEMBL5499710 0.90 HCRTR1 (0.37) BTKLMNAPOLBKMT2A
SCHEMBL5500218 0.84 MMP13 (0.38) MEN1KMT2AHTR2AHTR2CHTR2B
SCHEMBL5503441 0.84 TACR1 (0.36) POLB
SCHEMBL5501184 0.83 NPY5R (0.35) BTKDPP4DPP8DPP9LTA4H
SCHEMBL5509855 0.82 CYP11B2 (0.39)
SCHEMBL5507807 0.82 HRH3 (0.39) LMNALTA4H
SCHEMBL5500031 0.81 P2RX7 (0.44) DPP4DPP8DPP9KMT2AP2RX7
SCHEMBL5499654 0.81 LMNA (0.43) BTKDPP4DPP8DPP9LMNA

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