SCHEMBL4028478

SCHEMBL4028478

CC(C)Oc1cc(Cl)c(Cc2[nH]nc3c2CC(N2CCCC2=O)CC3)c(Cl)c1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.35
OPRL1 P41146 1/20 0.34
F10 P00742 1/20 0.31
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 1/20 0.30

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
SCHEMBL4024429 0.90 OPRL1 (0.35) KDM5AOPRL1F10
SCHEMBL4025157 0.85 KDM5A (0.34) KDM5AOPRL1F10
SCHEMBL4031855 0.85 KDM5A (0.34) KDM5AOPRL1F10
SCHEMBL4023855 0.85 KDM5A (0.34) KDM5AOPRL1F10
SCHEMBL4024182 0.84 LTA4H (0.34) OPRL1
SCHEMBL4024126 0.83 LTA4H (0.34)
SCHEMBL4022622 0.83 LTA4H (0.34)
SCHEMBL4024067 0.81 NPY5R (0.35) KDM5AOPRL1
SCHEMBL4030735 0.81 NPY5R (0.35) KDM5AOPRL1
SCHEMBL4029262 0.81 NPY5R (0.35) KDM5AOPRL1

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-2029579-A2 CYCLOHEXYLPYRAZOLE-LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2009-03-04 EP disclosed
WO-2007124254-A2 CYCLOHEXYLPYRAZOLE-LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-11-01 WO disclosed