SCHEMBL28749510

SCHEMBL28749510

CS(=O)(=O)c1ccc([C@H](CC(=O)O)C2CCC(C=O)C2)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 6/20 0.39
▸ PTGDR Q13258 6/20 0.38
▸ TBXA2R P21731 4/20 0.38
▸ KCNH2 Q12809 2/20 0.37
▸ GCK P35557 4/20 0.36
▸ SLC6A2 P23975 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ SLC6A3 Q01959 1/20 0.36
▸ PDE2A O00408 2/20 0.35

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
SCHEMBL27467646 0.83 KCNH2 (0.46) FFAR1PTGDRTBXA2RKCNH2GCK
SCHEMBL27502236 0.83 KCNH2 (0.46) FFAR1PTGDRTBXA2RKCNH2GCK
SCHEMBL27558086 0.81 GCK (0.44) FFAR1PTGDRTBXA2RKCNH2GCK
SCHEMBL27765336 0.80 GCK (0.42) FFAR1PTGDRTBXA2RKCNH2GCK
SCHEMBL27558109 0.79 GCK (0.47) FFAR1PTGDRTBXA2RKCNH2GCK
SCHEMBL27578470 0.79 GCK (0.47) FFAR1PTGDRTBXA2RKCNH2GCK
SCHEMBL28749511 0.77 KCNH2 (0.47) PTGDRTBXA2RKCNH2GCKPDE2A
SCHEMBL27575894 0.75 ALDH1A1 (0.43) PTGDRTBXA2RKCNH2GCKPDE2A
SCHEMBL27616381 0.73 KCNH2 (0.45) PTGDRTBXA2RKCNH2GCKSLC6A2
SCHEMBL27765347 0.73 GCK (0.42) PTGDRTBXA2RKCNH2GCKSLC6A2

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
CN-1329386-C Substituted phenylacetamides and their use as glucokinase activators HOFFMANN LA ROCHE CO LTD (CH) 2007-08-01 — — CN disclosed
CN-1649859-A Substituted phenylacetamides and their use as glucokinase activators HOFFMANN LA ROCHE (CH) 2005-08-03 — — CN disclosed
Send feedback