SCHEMBL13703963

SCHEMBL13703963

C=C(Nc1ncc(C(=O)O)s1)c1cc(/C=C\C(C)C)cc(OC(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 10/20 0.39
▸ FFAR2 O15552 1/20 0.37
▸ CSNK2A2 P19784 3/20 0.35
▸ CSNK2A1 P68400 3/20 0.35
▸ RARA P10276 1/20 0.35
▸ RARB P10826 1/20 0.35
▸ RARG P13631 1/20 0.35
▸ PRKAB2 O43741 1/20 0.34
▸ PRKAG1 P54619 1/20 0.34
▸ PRKAA2 P54646 1/20 0.34
▸ PRKAA1 Q13131 1/20 0.34
▸ PRKAG3 Q9UGI9 1/20 0.34
▸ PRKAG2 Q9UGJ0 1/20 0.34
▸ PRKAB1 Q9Y478 1/20 0.34
▸ MAPK13 O15264 1/20 0.34
▸ MAPK12 P53778 1/20 0.34
▸ MAPK11 Q15759 1/20 0.34
▸ MAPK14 Q16539 1/20 0.34
▸ CCNE1 P24864 1/20 0.33
▸ CDK2 P24941 1/20 0.33

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
SCHEMBL2664563 0.91 GCK (0.46) GCKCSNK2A2CSNK2A1RARARARB
SCHEMBL14191883 0.90 FFAR2 (0.41) GCKFFAR2CSNK2A2CSNK2A1RARA
SCHEMBL14546873 0.84 FFAR2 (0.40) GCKFFAR2CSNK2A2CSNK2A1RARA
SCHEMBL14092862 0.82 FFAR2 (0.37) GCKFFAR2CSNK2A2CSNK2A1RARA
SCHEMBL2664562 0.80 GCK (0.46) GCKFFAR2CSNK2A2CSNK2A1RARA
SCHEMBL13678510 0.80 GCK (0.40) GCKFFAR2RARARARBRARG
SCHEMBL2664723 0.78 GCK (0.51) GCKCSNK2A2CSNK2A1RARARARB
SCHEMBL2666434 0.75 GCK (0.44) GCKCSNK2A2CSNK2A1RARARARB
SCHEMBL14546724 0.75 GCK (0.62) GCKFFAR2CSNK2A2CSNK2A1RARA
SCHEMBL2664568 0.73 GCK (0.46) GCKCSNK2A2CSNK2A1RARARARB

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
EP-1529530-B3 Compounds affecting glucokinase ASTRAZENECA AB (SE) 2009-09-02 — — EP disclosed
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