SCHEMBL381971

SCHEMBL381971

CCNC(=O)ON1CCC(N2CCC(Cc3c(Cl)cc(-c4ccc(F)cc4)cc3Cl)C2=O)CC1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 7/20 0.33
APOL1 O14791 1/20 0.33
HSD11B1 P28845 1/20 0.32
ROCK2 O75116 1/20 0.32
MCHR1 Q99705 1/20 0.32
P2RX7 Q99572 1/20 0.32
CTSS P25774 1/20 0.32
DPP4 P27487 1/20 0.32
DPP7 Q9UHL4 1/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
PIK3CA P42336 1/20 0.32
ACACB O00763 1/20 0.31
TP53 P04637 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 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
SCHEMBL381812 0.91 CHRM3 (0.33) CHRM3HSD11B1ROCK2TP53HDAC3
SCHEMBL381487 0.89 ROCK2 (0.36) CHRM3HSD11B1ROCK2TP53
SCHEMBL381326 0.86 EPHX2 (0.40) APOL1DPP4DPP7MAPK1TP53
SCHEMBL13031210 0.86 EPHX2 (0.40) APOL1DPP4DPP7MAPK1TP53
SCHEMBL381541 0.85 MAPT (0.34) HSD11B1MCHR1LMNATP53
SCHEMBL15204265 0.84 HSD11B1 (0.42) HSD11B1ACHE
SCHEMBL381499 0.83 MCHR1 (0.34) CHRM3HSD11B1MCHR1CTSS
SCHEMBL381332 0.83 MCHR1 (0.34) CHRM3HSD11B1MCHR1CTSS
SCHEMBL381752 0.83 PKM (0.39) CHRM3HSD11B1LMNAMAPK1L3MBTL1
SCHEMBL381753 0.83 PKM (0.39) CHRM3HSD11B1LMNAMAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049513-B1 PIPERIDINYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2012-01-25 EP claimed