SCHEMBL416496

SCHEMBL416496

CC(C)(C)OC(=O)N1CCC(N2CCC(Cc3c(Cl)cc(-c4ccc(C(=O)N5CCOCC5)cc4)cc3Cl)C2=O)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.44
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HRH3 Q9Y5N1 4/20 0.41
TP53 P04637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
USP30 Q70CQ3 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
ADRA2C P18825 1/20 0.40
CHRM3 P20309 1/20 0.40
DRD4 P21917 1/20 0.40
SLC6A2 P23975 1/20 0.40
HRH2 P25021 1/20 0.40
SLC6A4 P31645 1/20 0.40
HRH1 P35367 1/20 0.40
SLC6A3 Q01959 1/20 0.40
HRH4 Q9H3N8 1/20 0.40
HDAC4 P56524 1/20 0.40
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL416495 1.00 GPR119 (0.44) GPR119MEN1KMT2AHRH3TP53
SCHEMBL412036 0.91 HRH3 (0.43) MEN1KMT2AHRH3NPSR1CHRM2
SCHEMBL412037 0.91 HRH3 (0.43) MEN1KMT2AHRH3NPSR1CHRM2
SCHEMBL381094 0.90 HDAC4 (0.41) GPR119MEN1KMT2ATP53USP30
SCHEMBL381093 0.90 HDAC4 (0.41) GPR119MEN1KMT2ATP53USP30
SCHEMBL210630 0.90 KMT2A (0.48) GPR119MEN1KMT2ATP53HDAC4
SCHEMBL381061 0.88 TP53 (0.44) GPR119KMT2ATP53USP30FPR2
SCHEMBL381060 0.88 TP53 (0.44) GPR119KMT2ATP53USP30FPR2
SCHEMBL380482 0.88 HDAC4 (0.41) GPR119MEN1KMT2ATP53HDAC4
SCHEMBL380481 0.88 HDAC4 (0.41) GPR119MEN1KMT2ATP53HDAC4

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-2049513-B1 PIPERIDINYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2012-01-25 EP disclosed
US-7829582-B2 Piperidinyl substituted pyrrolidinones as inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 ELI LILLY AND COMPANY (US) 2010-11-09 US disclosed