SCHEMBL1260293

SCHEMBL1260293

Cc1c(S(N)(=O)=O)sc2cccc(Br)c12

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 11/20 0.42
CA1 P00915 6/20 0.37
CA4 P22748 2/20 0.37
CA6 P23280 2/20 0.37
SLC9A1 P19634 2/20 0.35
CA12 O43570 2/20 0.34
CA7 P43166 2/20 0.34
CA14 Q9ULX7 1/20 0.34
CA9 Q16790 3/20 0.33
PTGS2 P35354 3/20 0.33
MAPT P10636 1/20 0.32
CA5A P35218 2/20 0.32
PFKFB3 Q16875 1/20 0.31
PFKFB4 Q16877 1/20 0.31
PTGS1 P23219 2/20 0.31
CA3 P07451 1/20 0.31
CA5B Q9Y2D0 1/20 0.31
STING1 Q86WV6 1/20 0.30

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
SCHEMBL4790572 0.78 LIMK1 (0.42) CA2CA1SLC9A1CA12CA9
SCHEMBL1575935 0.73 HSD11B1 (0.44) CA2CA1CA4CA12CA7
SCHEMBL21234346 0.70 GPR3 (0.39) CA2SLC9A1CA12CA9MAPT
SCHEMBL1260771 0.69 PTGS2 (0.34) CA2CA1CA6CA12CA7
SCHEMBL788101 0.69 PKM (0.33) SLC9A1MAPT
SCHEMBL4790575 0.68 L3MBTL1 (0.46) CA2CA1CA4CA6CA12
SCHEMBL3816392 0.68 LMNA (0.48) MAPT
SCHEMBL19502377 0.68 TUBB4A (0.31)
SCHEMBL3690288 0.68 MCL1 (0.41) SLC9A1MAPTPFKFB3PFKFB4
SCHEMBL22909023 0.66 ALDH1A1 (0.56) CA2CA1CA12CA7CA14

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
WO-2011022207-A1 BIS-SULFONAMIDE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE HIGH POINT PHARMACEUTICALS, LLC (US) 2011-02-24 WO disclosed