SCHEMBL9058792

SCHEMBL9058792

CCCN1Sc2sc(S(N)(=O)=O)cc2C=C1CN(CCOC)CCOC

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA2 P00918 20/20 0.48
CA4 P22748 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
SCHEMBL9063305 0.94 CA2 (0.50) CA2CA4
SCHEMBL9118189 0.92 CA2 (0.50) CA2
SCHEMBL9057821 0.84 CA2 (0.48) CA2CA4
SCHEMBL9058327 0.83 CA2 (0.44) CA2CA4
SCHEMBL9058163 0.79 CA2 (0.46) CA2CA4
SCHEMBL9058135 0.79 CA2 (0.45) CA2CA4
SCHEMBL9058891 0.78 CA2 (0.38) CA2CA4
SCHEMBL9058810 0.74 CA2 (0.32) CA2
SCHEMBL8950282 0.74 CA2 (0.49) CA2CA4
SCHEMBL8950251 0.73 CA2 (0.48) CA2CA4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996022099-A1 OPHTHALMIC COMPOSITIONS FOR TREATING GLAUCOMA ALCON LABORATORIES, INC. (US) 1996-07-25 WO disclosed
WO-1995019981-A1 THIENOTHIAZINE SULFONAMIDE DERIVATIVES PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND THEIR USE AS CARBONIC ANHYDRASE INHIBITORS ALCON LABORATORIES, INC. (US) 1995-07-27 WO disclosed