SCHEMBL27734788

SCHEMBL27734788

Cc1cc(C)c2c(c1)C(C=NO)CCC2

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
UGT2B17 O75795 2/20 0.57
KDM4C Q9H3R0 1/20 0.35
SIGMAR1 Q99720 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL15287102 0.79 UGT2B17 (0.57) UGT2B17KDM4CSIGMAR1SMN1; SMN2
SCHEMBL27714191 0.77 KMT2A (0.36) UGT2B17SMN1; SMN2
SCHEMBL6799194 0.73 UGT2B17 (1.00) UGT2B17KDM4CSIGMAR1SMN1; SMN2
SCHEMBL27785664 0.71 KDM4C (0.37) KDM4C
SCHEMBL28383841 0.71 KDM4C (0.37) KDM4C
SCHEMBL20342819 0.70 DRD2 (0.39)
SCHEMBL24543484 0.70 UGT2B17 (0.37) UGT2B17
SCHEMBL5272877 0.69 UGT2B17 (0.62) UGT2B17KDM4CSIGMAR1
SCHEMBL703510 0.69 UGT2B17 (0.62) UGT2B17KDM4CSIGMAR1
SCHEMBL30831935 0.69 UGT2B17 (0.62) UGT2B17KDM4CSIGMAR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101400336-B Novel flavoring agents, taste modifiers, tastants, taste enhancers, umami or sweeteners and/or enhancers and uses thereof SENOMYX INC 2013-06-05 CN disclosed
CN-101400336-A Novel flavoring agents, taste modifiers, tastants, taste enhancers, umami or sweeteners and/or enhancers and uses thereof SENOMYX INC (US) 2009-04-01 CN disclosed
CN-101203142-A Aromatic amides and ureas and their uses as sweet and/or delicate flavor modifiers, flavouring agents and taste enhancers SENOMYX INC (US) 2008-06-18 CN disclosed