SCHEMBL7394243

SCHEMBL7394243

COC(=O)CCc1ccc(N2CC(=O)N(CCC3CCN(C(=O)OC(C)(C)C)CC3)C2=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.41
KDM4E B2RXH2 1/20 0.41
PKM P14618 1/20 0.41
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
BACE1 P56817 1/20 0.39
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
HRH3 Q9Y5N1 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
SCHEMBL7389941 0.86 S1PR1 (0.43) GPR119KDM4EPKMALDH1A1LMNA
SCHEMBL7484914 0.85 GPR119 (0.42) GPR119KDM4EPKMALDH1A1LMNA
SCHEMBL7391404 0.85 GPR119 (0.41) GPR119KDM4EPKMALDH1A1LMNA
SCHEMBL7389887 0.84 HRH3 (0.41) GPR119KDM4EPKMALDH1A1LMNA
SCHEMBL7360610 0.81 GPR119 (0.51) GPR119ALDH1A1LMNATP53
SCHEMBL7393944 0.81 GPR119 (0.41) GPR119KDM4EPKMALDH1A1LMNA
SCHEMBL7358096 0.81 HRH3 (0.41) GPR119KDM4EPKMALDH1A1LMNA
SCHEMBL7392102 0.80 GPR119 (0.43) GPR119KDM4EPKMALDH1A1LMNA
SCHEMBL7394493 0.79 TP53 (0.42) GPR119KDM4EPKMALDH1A1LMNA
SCHEMBL7481273 0.79 GPR119 (0.41) GPR119KDM4EPKMALDH1A1LMNA

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-0587134-A2 Cyclic urea derivatives, medicaments containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1994-03-16 EP disclosed