SCHEMBL28040244

SCHEMBL28040244

CC(C)(C)OC(=O)N1CCNCC1c1cccc(NS(C)(=O)=O)c1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 10/20 0.45
NR1H3 Q13133 9/20 0.45
RXRA P19793 4/20 0.42
PTPN1 P18031 4/20 0.42
HRH3 Q9Y5N1 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
GPR119 Q8TDV5 1/20 0.39
LMNA P02545 1/20 0.38
HCRTR2 O43614 1/20 0.38

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
SCHEMBL30595864 0.82 RIPK1 (0.53) NR1H2NR1H3RXRAKDM4EALDH1A1
SCHEMBL2640496 0.81 NR1H2 (0.45) NR1H2NR1H3RXRAGPR119
SCHEMBL4325057 0.80 NR1H2 (0.49) NR1H2NR1H3RXRAGPR119
SCHEMBL22285173 0.80 NR1H2 (0.49) NR1H2NR1H3RXRAGPR119
SCHEMBL874416 0.80 NR1H2 (0.49) NR1H2NR1H3RXRAGPR119
SCHEMBL3201139 0.79 NR1H2 (0.44) NR1H2NR1H3RXRA
SCHEMBL16835137 0.76 ALOX12 (0.59) HRH3KDM4EGPR119
SCHEMBL3697218 0.75 DPP4 (0.47) NR1H2NR1H3
SCHEMBL25913721 0.75 DPP4 (0.47) NR1H2NR1H3
SCHEMBL28371859 0.75 GPR119 (0.46) KDM4EALDH1A1GPR119LMNA

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
CN-102459258-B Preparation and use of 1,2, 4-triazolo [1,5a ] pyridine derivatives CEPHALON, INC. (US) 2015-11-25 CN disclosed