SCHEMBL10296133

SCHEMBL10296133

CNC1CCN(Cc2ccccc2)CC1C(=O)OC

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.49
LTA4H P09960 1/20 0.49
SIGMAR1 Q99720 1/20 0.49
DRD2 P14416 3/20 0.48
DRD4 P21917 3/20 0.48
DRD3 P35462 2/20 0.48
SCN4A P35499 2/20 0.47

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
SCHEMBL10968782 0.85 SLC18A3 (0.54) MCHR1LTA4HSIGMAR1DRD2DRD4
SCHEMBL10968787 0.85 SLC18A3 (0.54) MCHR1LTA4HSIGMAR1DRD2DRD4
SCHEMBL10968786 0.85 SLC18A3 (0.54) MCHR1LTA4HSIGMAR1DRD2DRD4
SCHEMBL1337120 0.84 SIGMAR1 (0.50) MCHR1LTA4HSIGMAR1DRD2DRD4
SCHEMBL28332659 0.84 SIGMAR1 (0.50) MCHR1LTA4HSIGMAR1DRD2DRD4
Hydrochloric Acid SCHEMBL31196825 0.82 MCHR1 (0.49) MCHR1LTA4HSIGMAR1DRD2DRD4
SCHEMBL585358 0.82 S1PR5 (0.53) SIGMAR1
SCHEMBL6232439 0.82 S1PR5 (0.53) SIGMAR1
SCHEMBL585357 0.82 S1PR5 (0.53) SIGMAR1
SCHEMBL6232433 0.82 S1PR5 (0.53) SIGMAR1

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-2471363-A1 Use of aryl-, heteroaryl- and benzylsulfonamide carboxylic acids, -carboxylic acid esters, -carboxylic acid amides and -carbonitriles and/or its salts for increasing stress tolerance in plants Bayer CropScience AG (DE) 2012-07-04 EP disclosed