SCHEMBL13757089

SCHEMBL13757089

Cc1cnc(NC(=O)[C@]2(c3ccc(S(C)(=O)=O)cc3)C[C@H]2C2CCCCC2)s1

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 3/20 0.72
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ RAB9A P51151 4/20 0.45
▸ NPC1 O15118 3/20 0.45
▸ GAA P10253 1/20 0.45
▸ ATR Q13535 1/20 0.45
▸ LMNA P02545 2/20 0.43
▸ PKM P14618 1/20 0.43
▸ NR3C1 P04150 1/20 0.42
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ EPHX2 P34913 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ CLK1 P49759 1/20 0.38
▸ PRNP P04156 1/20 0.37

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
SCHEMBL1581916 1.00 GCK (0.72) GCKSMN1; SMN2RAB9ANPC1GAA
SCHEMBL13757060 0.90 GCK (0.70) GCKCLK1
SCHEMBL12720676 0.90 GCK (0.70) GCK
SCHEMBL1581811 0.90 GCK (0.70) GCKCLK1
SCHEMBL1582188 0.90 GCK (0.70) GCK
SCHEMBL1581814 0.89 GCK (0.69) GCK
SCHEMBL12720709 0.89 GCK (0.69) GCK
SCHEMBL2666178 0.84 GCK (0.68) GCKSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL1581823 0.84 GCK (0.68) GCKSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL362258 0.83 GCK (1.00) GCKSMN1; SMN2LMNAMEN1KMT2A

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
US-7576108-B2 Substituted arylcyclopropylacetamides as glucokinase activators ELI LILLY AND COMPANY (US) 2009-08-18 — — US disclosed
US-7576108-B2 Substituted arylcyclopropylacetamides as glucokinase activators ELI LILLY AND COMPANY (US) 2009-08-18 — — US disclosed
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