SCHEMBL27465661

SCHEMBL27465661

CCC(=O)OC(c1ccc(S(C)(=O)=O)c(Cl)c1)C1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 2/20 0.43
▸ SLC6A3 Q01959 6/20 0.41
▸ GCK P35557 6/20 0.40
▸ LMNA P02545 1/20 0.39
▸ SLC6A2 P23975 5/20 0.36
▸ SLC6A4 P31645 5/20 0.36
▸ ALOX5 P09917 1/20 0.34
▸ TBXA2R P21731 1/20 0.34
▸ PTGDR Q13258 1/20 0.34

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
SCHEMBL27467641 0.86 ALDH1A1 (0.32) KCNH2SLC6A3GCKLMNA
SCHEMBL27465660 0.79 SLC6A3 (0.40) SLC6A3LMNASLC6A2SLC6A4ALOX5
SCHEMBL27523626 0.76 KMT2A (0.45) SLC6A3LMNA
SCHEMBL27502236 0.75 KCNH2 (0.46) KCNH2SLC6A3GCKSLC6A2SLC6A4
SCHEMBL27467646 0.75 KCNH2 (0.46) KCNH2SLC6A3GCKSLC6A2SLC6A4
SCHEMBL27616381 0.74 KCNH2 (0.45) KCNH2SLC6A3GCKLMNASLC6A2
SCHEMBL2645933 0.72 KCNH2 (0.59) KCNH2SLC6A3GCKSLC6A2SLC6A4
SCHEMBL2668923 0.71 KCNH2 (0.44) KCNH2SLC6A3GCKLMNASLC6A2
SCHEMBL2653002 0.71 KCNH2 (0.44) KCNH2SLC6A3GCKLMNASLC6A2
SCHEMBL27635484 0.71 SLC6A3 (0.44) KCNH2SLC6A3GCKSLC6A2SLC6A4

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-1151140-C Glucokinase activators - 2004-05-26 — — CN disclosed
CN-1349519-A Glucokinase activators HOFFMANN LA ROCHE (CH) 2002-05-15 — — CN disclosed
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