SCHEMBL9054354

SCHEMBL9054354

CCOC(=O)CN(C(=O)[C@H](CCC(N)c1ncc[nH]1)NS(=O)(=O)c1cc(Cl)c(N)c(Cl)c1)C1CC1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR10 P46092 16/20 0.40
HSD11B1 P28845 1/20 0.33
F10 P00742 1/20 0.32

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
SCHEMBL9054627 0.96 CCR10 (0.39) CCR10
SCHEMBL9056575 0.89 CCR10 (0.41) CCR10
SCHEMBL9057599 0.86 CCR10 (0.40) CCR10
SCHEMBL9055073 0.86 CCR10 (0.40) CCR10
SCHEMBL9055396 0.83 CCR10 (0.37) CCR10
SCHEMBL9054485 0.83 CCR10 (0.37) CCR10
SCHEMBL9055585 0.82 CCR10 (0.37) CCR10
SCHEMBL9055734 0.82 CCR10 (0.37) CCR10
SCHEMBL9056601 0.80 SLC16A3 (0.34)
SCHEMBL9056304 0.77 CCR10 (0.57) 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