SCHEMBL27575894

SCHEMBL27575894

CS(=O)(=O)c1ccc([C@H](CC(=O)O)C2CCCC2=O)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.43
▸ PTGDR Q13258 9/20 0.43
▸ TBXA2R P21731 6/20 0.43
▸ KCNH2 Q12809 2/20 0.41
▸ GCK P35557 4/20 0.40
▸ PDE2A O00408 3/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40

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 0.84 KCNH2 (0.46) PTGDRTBXA2RKCNH2GCKPDE2A
SCHEMBL27502236 0.84 KCNH2 (0.46) PTGDRTBXA2RKCNH2GCKPDE2A
SCHEMBL27558086 0.83 GCK (0.44) PTGDRTBXA2RKCNH2GCKPDE2A
SCHEMBL27558004 0.83 ALDH1A1 (0.46) ALDH1A1PTGDRTBXA2RKCNH2GCK
SCHEMBL27558109 0.81 GCK (0.47) PTGDRTBXA2RKCNH2GCKPDE2A
SCHEMBL27558059 0.81 ALDH1A1 (0.42) ALDH1A1KDM4ENPC1TP53HPGD
SCHEMBL27578470 0.81 GCK (0.47) PTGDRTBXA2RKCNH2GCKPDE2A
SCHEMBL27765336 0.81 GCK (0.42) ALDH1A1PTGDRTBXA2RKCNH2GCK
SCHEMBL2641961 0.77 KCNH2 (0.46) PTGDRTBXA2RKCNH2GCKPDE2A
SCHEMBL2642548 0.77 KCNH2 (0.46) PTGDRTBXA2RKCNH2GCKPDE2A

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
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