SCHEMBL6231353

SCHEMBL6231353

CN(C)C=NS(=O)(=O)c1ccccc1S(=O)(=O)c1ccc(Cn2c(-c3ccccc3)nc(Cl)c2C=O)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.36
LMNA P02545 2/20 0.34
GAA P10253 1/20 0.34
ALDH1A1 P00352 3/20 0.33
NPSR1 Q6W5P4 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
TP53 P04637 1/20 0.33
MAS1 P04201 1/20 0.33
AGTR1 P30556 1/20 0.33
AGTR2 P50052 1/20 0.33
CNR1 P21554 1/20 0.32
GP6 Q9HCN6 1/20 0.32
DHFR P00374 1/20 0.32
GHSR Q92847 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
SCHEMBL6231352 1.00 PTGDR2 (0.36) PTGDR2LMNAGAAALDH1A1NPSR1
SCHEMBL7614742 0.88 GP6 (0.39) MAS1AGTR1AGTR2GP6
SCHEMBL7614735 0.88 GP6 (0.39) MAS1AGTR1AGTR2GP6
SCHEMBL6229258 0.83 PTGDR2 (0.39) PTGDR2LMNAALDH1A1NPSR1SMN1; SMN2
SCHEMBL7652319 0.82 TP53 (0.38) GAASMN1; SMN2TP53MAS1GP6
SCHEMBL7652327 0.82 TP53 (0.38) GAASMN1; SMN2TP53MAS1GP6
SCHEMBL6230300 0.81 LMNA (0.35) LMNAGAAALDH1A1NPSR1SMN1; SMN2
SCHEMBL6230301 0.81 LMNA (0.35) LMNAGAAALDH1A1NPSR1SMN1; SMN2
SCHEMBL7262643 0.78 PTGDR2 (0.36) PTGDR2LMNAALDH1A1SMN1; SMN2TP53
SCHEMBL11160756 0.74 ALDH1A1 (0.51) LMNAGAAALDH1A1NPSR1SMN1; SMN2

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