SCHEMBL5319909

SCHEMBL5319909

Cc1ccc2c(c1)C(NC(=O)c1cccc(Cl)c1O)CCC2

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 14/20 0.74
TAS1R1 Q7RTX1 14/20 0.74
TAS1R2 Q8TE23 12/20 0.74
ALDH1A1 P00352 1/20 0.60
LMNA P02545 1/20 0.54
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51

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
SCHEMBL5270028 0.86 TAS1R3 (0.86) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1
SCHEMBL5270033 0.86 TAS1R3 (0.86) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1
SCHEMBL701855 0.85 TAS1R3 (1.00) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1
SCHEMBL701854 0.85 TAS1R3 (1.00) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1
SCHEMBL20860976 0.82 TAS1R3 (0.93) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1
SCHEMBL27102879 0.82 TAS1R3 (0.73) TAS1R3TAS1R1TAS1R2ALDH1A1LMNA
SCHEMBL5923912 0.81 TAS1R3 (0.81) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1
SCHEMBL5923909 0.81 TAS1R3 (0.81) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1
SCHEMBL701117 0.81 TAS1R3 (1.00) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1
SCHEMBL5923959 0.81 TAS1R3 (1.00) TAS1R3TAS1R1TAS1R2ALDH1A1MEN1

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
EP-1848289-A2 AROMATIC AMIDES AND UREAS AND THEIR USES AS SWEET AND/OR UMAMI FLAVOR MODIFIERS, TASTANTS AND TASTE ENHANCERS Senomyx, Inc. (US) 2007-10-31 EP disclosed
WO-2006084246-A2 AROMATIC AMIDES AND UREAS AND THEIR USES AS SWEET AND/OR UMAMI FLAVOR MODIFIERS, TASTANTS AND TASTE ENHANCERS SENOMYX, INC. (US) 2006-08-10 WO disclosed
US-20060045953-A1 Aromatic amides and ureas and their uses as sweet and/or umami flavor modifiers, tastants and taste enhancers SENOMYX, INC. 2006-03-02 US disclosed