SCHEMBL2665989

SCHEMBL2665989

Bc1ccc(/C(=C\C2CCOCC2)C(=O)O)cc1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GCK P35557 1/20 0.41
KMT2A Q03164 1/20 0.33
AKR1C1 Q04828 1/20 0.31

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
SCHEMBL3390559 0.85 NPC1 (0.41) GCKKMT2A
SCHEMBL3390564 0.85 NPC1 (0.41) GCKKMT2A
SCHEMBL3393082 0.81 ALDH1A1 (0.45) GCKKMT2A
SCHEMBL3393075 0.81 ALDH1A1 (0.45) GCKKMT2A
SCHEMBL3389283 0.81 AKR1C3 (0.47) GCKKMT2AAKR1C1
SCHEMBL3389287 0.81 AKR1C3 (0.47) GCKKMT2AAKR1C1
SCHEMBL2665988 0.81 GCK (0.39) GCKKMT2A
SCHEMBL2650569 0.80 GCK (0.61) GCKAKR1C1
SCHEMBL3387068 0.80 TDP1 (0.45) GCK
SCHEMBL3387063 0.80 TDP1 (0.45) GCK

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
WO-2004072031-A2 PHENYLACETAMIDES AND THEIR USE AS GLUCOKINASE MODULATORS PROSIDION LIMITED (GB) 2004-08-26 WO disclosed