SCHEMBL8714833

SCHEMBL8714833

CCNC1CN(c2cccc(O)c2)S(=O)(=O)c2sc(S(N)(=O)=O)cc21

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 17/20 0.59
CA1 P00915 3/20 0.55
CA12 O43570 2/20 0.55
CA4 P22748 2/20 0.55
CA6 P23280 2/20 0.55
CA5A P35218 2/20 0.55
CA7 P43166 2/20 0.55
CA9 Q16790 2/20 0.55
CA13 Q8N1Q1 2/20 0.55
CA14 Q9ULX7 2/20 0.55
CA5B Q9Y2D0 2/20 0.55
LMNA P02545 2/20 0.55
CA3 P07451 1/20 0.53
AR P10275 1/20 0.53
TSHR P16473 1/20 0.53

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
SCHEMBL8704983 1.00 CA2 (0.59) CA2CA1CA12CA4CA6
Hydrochloric Acid SCHEMBL8706403 0.99 CA2 (0.58) CA2CA1CA12CA4CA6
Hydrochloric Acid SCHEMBL8869995 0.92 CA2 (0.55) CA2CA1CA12CA4CA6
SCHEMBL8705889 0.89 CA2 (0.62) CA2CA1CA12CA4CA6
Hydrochloric Acid SCHEMBL8709362 0.89 CA2 (0.61) CA2CA1CA12CA4CA6
SCHEMBL8710281 0.88 CA2 (0.59) CA2CA1CA12CA4CA6
SCHEMBL8705361 0.88 CA2 (0.59) CA2CA1CA12CA4CA6
Hydrochloric Acid SCHEMBL8705615 0.87 CA2 (0.58) CA2CA1CA12CA4CA6
SCHEMBL9262639 0.86 CA2 (0.44) CA2CA1CA12CA4CA6
SCHEMBL8710402 0.83 CA2 (0.65) CA2CA1CA12CA4CA6

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-0625903-B1 TOPICAL ANTIGLAUCOMA COMPOSITIONS COMPRISING CARBONIC ANHYDRASE INHIBITORS AND BETA-BLOCKERS ALCON LAB INC (US) 1998-08-12 EP claimed