SCHEMBL2226084

SCHEMBL2226084

COC(=O)C1CN(Cc2ccccc2)C[C@H]1c1ccc(Cl)c(Cl)c1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 7/20 0.58
SLC6A4 P31645 6/20 0.58
SLC6A2 P23975 1/20 0.58
RORC P51449 1/20 0.50
F10 P00742 3/20 0.49
PRSS1 P07477 2/20 0.49

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
SCHEMBL2781321 1.00 SLC6A3 (0.58) SLC6A3SLC6A4SLC6A2RORCF10
SCHEMBL190976 1.00 SLC6A3 (0.58) SLC6A3SLC6A4SLC6A2RORCF10
SCHEMBL1972348 1.00 SLC6A3 (0.58) SLC6A3SLC6A4SLC6A2RORCF10
SCHEMBL1713696 1.00 SLC6A3 (0.58) SLC6A3SLC6A4SLC6A2RORCF10
SCHEMBL1977849 1.00 SLC6A3 (0.58) SLC6A3SLC6A4SLC6A2RORCF10
SCHEMBL190977 1.00 SLC6A3 (0.58) SLC6A3SLC6A4SLC6A2RORCF10
SCHEMBL30693235 1.00 SLC6A3 (0.58) SLC6A3SLC6A4SLC6A2RORCF10
SCHEMBL1892809 0.90 SLC6A4 (0.47) SLC6A3SLC6A4SLC6A2RORCF10
SCHEMBL2354780 0.90 SLC6A4 (0.47) SLC6A3SLC6A4SLC6A2RORCF10
SCHEMBL1974759 0.90 SLC6A4 (0.47) SLC6A3SLC6A4SLC6A2RORCF10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2513052-A1 PYRROLIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2012-10-24 EP disclosed
WO-2011085886-A1 PYRROLIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-07-21 WO disclosed