SCHEMBL28064359

SCHEMBL28064359

O=CC1C2CN(S(=O)(=O)c3ccccc3OC(F)(F)F)CC2CCN1c1ccc(OCC(F)(F)F)cc1

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 19/20 0.69
CHRM1 P11229 1/20 0.40

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
SCHEMBL28064277 0.89 LIPE (0.67) LIPE
SCHEMBL28064270 0.86 LIPE (0.64) LIPE
SCHEMBL13835975 0.82 LIPE (1.00) LIPE
SCHEMBL13835847 0.82 LIPE (1.00) LIPE
SCHEMBL28064213 0.77 LIPE (0.65) LIPE
SCHEMBL28827931 0.76 LIPE (0.47) LIPE
SCHEMBL28064278 0.73 LIPE (0.65) LIPE
SCHEMBL28064215 0.72 LIPE (0.42) LIPE
SCHEMBL13836089 0.71 LIPE (1.00) LIPE
SCHEMBL13836114 0.71 LIPE (1.00) LIPE

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
CN-103562180-B Novel six hydrogen cyclopenta pyrrolidone, hexahydropyrrolo pyrrolidone, octahydro pyrrolopyridinone and octahydro pyridinone compounds HOFFMAN-LA ROCHE LTD. (CH) 2016-04-20 CN disclosed