SCHEMBL6467893

SCHEMBL6467893

Cc1c(Br)cc(S(N)(=O)=O)cc1Br

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 14/20 0.62
CA9 Q16790 12/20 0.62
CA1 P00915 11/20 0.62
CA3 P07451 2/20 0.62
CA12 O43570 5/20 0.50
CA6 P23280 3/20 0.50
CA5A P35218 3/20 0.50
CA7 P43166 3/20 0.50
CA5B Q9Y2D0 3/20 0.50
CA4 P22748 2/20 0.50
CA14 Q9ULX7 2/20 0.50
APEX1 P27695 2/20 0.44
CYP2C19 P33261 1/20 0.44
ACP1 P24666 2/20 0.40
MAPT P10636 1/20 0.40
LMNA P02545 1/20 0.39
CYP2C9 P11712 1/20 0.39
CA13 Q8N1Q1 1/20 0.39
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL14175502 0.82 ACP1 (0.44) CA2CA9CA1CA3CA12
SCHEMBL22396640 0.78 ACP1 (0.39) CA2CA9CA1CA3CA12
SCHEMBL22394918 0.78 ACP1 (0.47) CA2CA9CA1CA3CA12
SCHEMBL11136228 0.77 CA2 (1.00) CA2CA9CA1CA3CA12
SCHEMBL8764033 0.77 CA2 (0.48) CA2CA9CA1CA3CA12
SCHEMBL4934516 0.76 PSIP1 (0.43) CA2CA9CA1CA3CA12
SCHEMBL25304157 0.75 CA1 (0.46) CA2CA9CA1CA3CA12
SCHEMBL10864491 0.75 CA1 (0.54) CA2CA9CA1CA3CA12
SCHEMBL9580693 0.75 CA2 (0.62) CA2CA9CA1CA3CA12
SCHEMBL1368195 0.75 CA2 (0.61) CA2CA9CA1CA3CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3302773-A1 SOLVENT COMPOSITIONS FOR USE AS HEPTANE REPLACEMENTS TBF Environmental Technology Inc. (CA) 2018-04-11 EP disclosed
WO-2016193866-A1 SOLVENT COMPOSITIONS FOR USE AS HEPTANE REPLACEMENTS TBF ENVIRONMENTAL TECHNOLOGY INC. (CA) 2016-12-08 WO disclosed
EP-1590397-A2 SURFACE PREPARATION OF RUBBER FOR COATINGS OR BONDING Lord Corporation (US) 2005-11-02 EP disclosed
WO-2004072156-A2 SURFACE PREPARATION OF RUBBER FOR COATINGS OR BONDING LORD CORPORATION (US) 2004-08-26 WO disclosed