SCHEMBL8060697

SCHEMBL8060697

CC1=CS(=O)(=O)c2cc(C(=O)Cl)c(C)cc21

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41

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
SCHEMBL8056469 0.77
SCHEMBL2154184 0.71 ALDH1A1 (0.37)
SCHEMBL11670395 0.69 SMN1; SMN2 (0.37)
SCHEMBL1313097 0.67 BCHE (0.39)
SCHEMBL8045037 0.67 USP7 (0.32) CA1CA2
SCHEMBL8058227 0.66
SCHEMBL23029879 0.63 CA1 (0.47) CA1CA2CA9
SCHEMBL7705491 0.62 SMN1; SMN2 (0.34)
SCHEMBL3827978 0.62 ALDH1A1 (0.45)
SCHEMBL7670684 0.61 GPR27 (0.38)

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
US-6028069-A Heterocyclyl-condensed benzoylguanidines, their production and use as inhibitors of the cellular Na+/H+-antiporter MERCK PATENT GESELLSCHAFT MIT BERSCHRANKER HAFTUNG (DE) 2000-02-22 US disclosed