SCHEMBL5501116

SCHEMBL5501116

O=C1CCCN1C1CCCC(O)(Cc2ccc(-c3ccncc3)cc2Cl)C1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.39
USP7 Q93009 2/20 0.35
NPY5R Q15761 4/20 0.35
P2RX7 Q99572 2/20 0.34
DPP4 P27487 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34
CTSS P25774 2/20 0.32
MCHR1 Q99705 1/20 0.32
GPR142 Q7Z601 1/20 0.32
CDC7 O00311 1/20 0.31
CDK9 P50750 1/20 0.31
CCR5 P51681 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
SCHEMBL5506180 0.77 AAK1 (0.34) HSD11B1NPY5RP2RX7DPP4DPP8
Hydrochloric Acid SCHEMBL5499646 0.76 AAK1 (0.33) HSD11B1NPY5RP2RX7DPP4DPP8
SCHEMBL5500612 0.72 NPY5R (0.36) HSD11B1USP7NPY5RP2RX7DPP4
SCHEMBL5500083 0.70 HCRTR1 (0.33) HSD11B1USP7P2RX7GPR142CDC7
Hydrochloric Acid SCHEMBL5505760 0.70 HCRTR1 (0.33) HSD11B1USP7GPR142
SCHEMBL5501423 0.69 HTR6 (0.34) HSD11B1NPY5RDPP4DPP8DPP9
SCHEMBL5500749 0.68 MEN1 (0.39) HSD11B1DPP4DPP8DPP9CTSS
Hydrochloric Acid SCHEMBL5506619 0.68 HTR6 (0.33) HSD11B1NPY5RDPP4DPP8DPP9
SCHEMBL5499827 0.68 P2RX7 (0.34) NPY5RP2RX7DPP4DPP8DPP9
SCHEMBL5504552 0.68 NPY5R (0.34) NPY5RP2RX7DPP4DPP8DPP9

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 claimed
WO-2006049952-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2006-05-11 WO claimed