SCHEMBL6256281

SCHEMBL6256281

NS(=O)(=O)c1cccc(Cc2cccc(CO)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 12/20 0.53
CA1 P00915 11/20 0.53
CA9 Q16790 8/20 0.52
CA12 O43570 6/20 0.52
CA14 Q9ULX7 4/20 0.52
CA4 P22748 2/20 0.52
CA5A P35218 2/20 0.52
CA6 P23280 1/20 0.52
CA7 P43166 1/20 0.52
CA5B Q9Y2D0 1/20 0.52
PTGES2 Q9H7Z7 1/20 0.46
ALDH1A1 P00352 1/20 0.43
PKM P14618 1/20 0.43
NOS1 P29475 1/20 0.42
ENPP2 Q13822 1/20 0.42

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
SCHEMBL185757 0.93 CA2 (0.61) CA2CA1CA9CA12CA14
SCHEMBL6252199 0.92 CA1 (0.59) CA2CA1CA9CA12CA14
Biphenyl SCHEMBL2902198 0.85 PTGES2 (0.54) CA2CA1CA9CA12CA14
SCHEMBL27901606 0.84 CA1 (0.62) CA2CA1CA9CA12CA14
SCHEMBL9999688 0.79 ENPP2 (0.54) NOS1ENPP2
SCHEMBL8196817 0.79 CA2 (0.61) CA2CA1CA9CA12CA14
SCHEMBL5436203 0.76 CA2 (0.64) CA2CA1CA9CA12CA14
SCHEMBL10586812 0.76 TSHR (0.53) CA2CA1CA9CA12CA14
SCHEMBL1795003 0.76 CA2 (0.64) CA2CA1CA9CA12CA14
SCHEMBL1775181 0.76 CA2 (0.64) CA2CA1CA9CA12CA14

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-1076651-B1 SUBSTITUTED SULPHONYL CYANAMIDES, METHOD FOR PRODUCING SAME AND THEIR USE AS MEDICAMENT AVENTIS PHARMA GMBH (DE) 2005-04-20 EP disclosed
US-6573288-B1 Compounds are inhibitors of the sodium-dependent bicarbonate/chloride ion exchanger which can be used as medicines for the prophylaxis or treatment of a wide range of diseases, for example the treatment and/or prophylaxis of AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-06-03 US disclosed
EP-1076651-A1 SUBSTITUTED SULPHONYL CYANAMIDES, METHOD FOR PRODUCING SAME AND THEIR USE AS MEDICAMENT Aventis Pharma Deutschland GmbH (DE) 2001-02-21 EP disclosed
WO-1999057102-A1 SUBSTITUTED SULPHONYL CYANAMIDES, METHOD FOR PRODUCING SAME AND THEIR USE AS MEDICAMENT AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 1999-11-11 WO disclosed