SCHEMBL6207136

SCHEMBL6207136

CS(=O)(=O)c1cc2c(cc1Sc1ccccc1)CC(Br)C2=O

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 12/20 0.36
KDM4E B2RXH2 1/20 0.34
NSD2 O96028 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
PTGS1 P23219 3/20 0.34
ADORA2A P29274 1/20 0.33
BRD4 O60885 2/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL6207083 0.79 PTGS2 (0.52) PTGS2KDM4ENSD2MAPTMAPK1
SCHEMBL6205822 0.73 L3MBTL1 (0.33) PTGS2PTGS1
SCHEMBL11190683 0.69 PTGS2 (0.50) PTGS2MAPTPTGS1BRD4
SCHEMBL6205723 0.67 PNMT (0.40) PTGS2PTGS1
SCHEMBL10789247 0.66 MAPT (0.46) PTGS2KDM4ENSD2MAPTMAPK1
SCHEMBL11657344 0.64 LMNA (0.52) KDM4ENSD2MAPTMAPK1KMT2A
SCHEMBL6206085 0.63 TDP2 (0.47) KDM4EMAPTMEN1KMT2A
SCHEMBL7178718 0.63 TYRO3 (0.49) KDM4EMAPTMEN1KMT2A
SCHEMBL11177396 0.62 PTGS2 (0.74) PTGS2PTGS1
SCHEMBL6190911 0.62 ACHE (0.38) KDM4EMAPTMEN1KMT2A

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-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