SCHEMBL9055846

SCHEMBL9055846

CC1CCN(C(=O)[C@H](CCCC(N)c2ncc[nH]2)NS(=O)(=O)c2cc(Cl)c(N)c(Cl)c2)CC1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCR10 P46092 16/20 0.66
F2 P00734 3/20 0.44

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
SCHEMBL9055806 1.00 CCR10 (0.66) CCR10F2
SCHEMBL9054473 0.95 CCR10 (0.68) CCR10
SCHEMBL9054465 0.95 CCR10 (0.68) CCR10
SCHEMBL9065791 0.92 CCR10 (0.65) CCR10F2
SCHEMBL9065789 0.92 CCR10 (0.65) CCR10F2
SCHEMBL9056304 0.87 CCR10 (0.57) CCR10
SCHEMBL9056300 0.87 CCR10 (0.57) CCR10
SCHEMBL9061843 0.86 CCR10 (0.65) CCR10F2
SCHEMBL9063275 0.86 CCR10 (0.65) CCR10F2
SCHEMBL9054991 0.85 CCR10 (0.54) CCR10

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
WO-1996002517-A1 SUBSTITUTED ARYLSULFONAMIDES, THEIR PREPARATION AND USE AS THROMBIN-INHIBITING MEDICAMENTS DR. KARL THOMAE GMBH (DE) 1996-02-01 WO disclosed