SCHEMBL16675671

SCHEMBL16675671

CCN(CC)CCC(=O)N1CCC(N(C)C(=O)COCCN(C)S(=O)(=O)c2c(C)cc(OC)cc2C)C1

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 20/20 0.62

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
SCHEMBL12010325 1.00 BDKRB1 (0.62) BDKRB1
SCHEMBL13063394 0.89 BDKRB1 (0.59) BDKRB1
SCHEMBL3440708 0.88 BDKRB1 (0.70) BDKRB1
SCHEMBL12010248 0.88 BDKRB1 (0.63) BDKRB1
SCHEMBL3440005 0.88 BDKRB1 (0.63) BDKRB1
SCHEMBL12010329 0.87 BDKRB1 (0.62) BDKRB1
SCHEMBL12010326 0.87 BDKRB1 (0.67) BDKRB1
SCHEMBL12010246 0.86 BDKRB1 (0.63) BDKRB1
SCHEMBL3439876 0.86 BDKRB1 (0.63) BDKRB1
SCHEMBL12010330 0.85 BDKRB1 (0.68) BDKRB1

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-2188251-B1 ARYLSULFONAMIDES WITH ANALGESIC ACTIVITY BOEHRINGER INGELHEIM INT (DE) 2015-04-29 EP disclosed