SCHEMBL7699554

SCHEMBL7699554

CCOC(=O)C1=Cc2cccc(S(N)(=O)=O)c2OCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.37
CA1 P00915 7/20 0.37
CA9 Q16790 4/20 0.37
CA12 O43570 3/20 0.37
CA7 P43166 1/20 0.37
CA14 Q9ULX7 1/20 0.37
PREP P48147 2/20 0.35
ALDH1A1 P00352 2/20 0.35
STS P08842 1/20 0.34
GAA P10253 2/20 0.34
MGAM O43451 1/20 0.34
AMY1A P0DUB6 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
CA5A P35218 1/20 0.34
NPC1 O15118 2/20 0.34
MAPT P10636 2/20 0.34
RAB9A P51151 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34

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
SCHEMBL7700172 0.90 ALDH1A1 (0.35) CA2CA1CA9CA12CA7
SCHEMBL7702817 0.90 ALDH1A1 (0.37) CA2CA1CA9CA12CA7
SCHEMBL7697790 0.89 ALDH1A1 (0.35) CA2CA1CA9CA12CA7
SCHEMBL7701172 0.87 TSHR (0.35) CA9CA12ALDH1A1GAAKMT2A
SCHEMBL7696668 0.84 CA12 (0.48) CA2CA1CA9CA12CA7
SCHEMBL7700693 0.84 CA1 (0.42) CA2CA1CA9CA12CA7
SCHEMBL7385154 0.83 ALDH1A1 (0.43) CA2CA1CA9CA12CA7
SCHEMBL7385304 0.83 MAPT (0.39) CA2CA1CA9CA12CA7
SCHEMBL7702331 0.83 ALDH1A1 (0.45) ALDH1A1GAAMAPTKDM4EHPGD
SCHEMBL7699846 0.82 TSHR (0.46) CA2CA1CA9CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6346527-B1 1-BENZOXEPIN DERIVATIVES USED IN THE PREVENTION OF SODIUM AND HYDROGEN ION EXCHANGE; CARDIOVASCULAR, KIDNEY AND BRAIN DISORDER TREATMENT; ARTERIOSCLEROSIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-02-12 US disclosed
EP-1073650-A1 GUANIDINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-02-07 EP disclosed
WO-1999055690-A1 GUANIDINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-11-04 WO disclosed