SCHEMBL6206319

SCHEMBL6206319

O=C1CCc2cc(Cl)c(S(=O)(=O)Cl)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.39
PTGS1 P23219 3/20 0.39
PBRM1 Q86U86 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TRPV4 Q9HBA0 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.35
HSD17B1 P14061 1/20 0.35
TSHR P16473 2/20 0.34
ALOX15 P16050 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
PRKCI P41743 1/20 0.33
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
GRM5 P41594 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL6205230 0.84 PTGS2 (0.44) PTGS2PTGS1PBRM1CASP1CASP7
SCHEMBL11660830 0.84 CA1 (0.47) PTGS2PTGS1PBRM1CASP1CASP7
SCHEMBL1512735 0.80 PBRM1 (0.47) PTGS2PTGS1PBRM1CASP1CASP7
SCHEMBL31591225 0.80 PBRM1 (0.47) PTGS2PTGS1PBRM1CASP1CASP7
SCHEMBL11659662 0.74 L3MBTL1 (0.43) PTGS2PTGS1L3MBTL1ALDH1A1
SCHEMBL6206980 0.73 CASP1 (0.50) PTGS2PTGS1PBRM1CASP1CASP7
SCHEMBL31511760 0.73 PBRM1 (0.41) PTGS2PTGS1PBRM1CASP1CASP7
SCHEMBL21962019 0.73 PBRM1 (0.41) PTGS2PTGS1PBRM1CASP1CASP7
SCHEMBL2907226 0.73 PBRM1 (0.41) PTGS2PTGS1PBRM1CASP1CASP7
SCHEMBL5200589 0.73 HSD17B1 (0.44) PTGS2PTGS1PBRM1CASP1CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1098891-B1 POLYCYCLIC THIAZOLIDIN-2-YLIDENE AMINES, METHOD FOR THE PRODUCTION AND USE THEREOF AS MEDICAMENTS AVENTIS PHARMA GMBH (DE) 2005-08-10 EP disclosed
EP-1098891-A1 POLYCYCLIC THIAZOLIDIN-2-YLIDENE AMINES, METHOD FOR THE PRODUCTION AND USE THEREOF AS MEDICAMENTS Aventis Pharma Deutschland GmbH (DE) 2001-05-16 EP disclosed
US-6159996-A Polycyclic thiazolidin-2-ylidene amines, process for their preparation, and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2000-12-12 US disclosed
WO-2000004006-A1 POLYCYCLIC THIAZOLIDIN-2-YLIDENE AMINES, METHOD FOR THE PRODUCTION AND USE THEREOF AS MEDICAMENTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2000-01-27 WO disclosed
US-4129656-A Thiazolidine derivatives, salidiuretic compositions and methods of effecting salidiuresis employing them HOECHST AKTIENGESELLSCHAFT (DE) 1978-12-12 US disclosed