SCHEMBL7190898

SCHEMBL7190898

O=P(O)(O)C(F)(F)c1ccc(CS(=O)(=O)Cc2cc[c]c(Br)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 15/20 0.47
PTPN2 P17706 6/20 0.47
PTPN6 P29350 5/20 0.47
PTPN11 Q06124 4/20 0.47
PGK1 P00558 3/20 0.47
PGK2 P07205 3/20 0.47
PTPRB P23467 3/20 0.43
PTPRC P08575 2/20 0.43
CDC25A P30304 1/20 0.43
EPM2A O95278 1/20 0.40
PTPN22 Q9Y2R2 1/20 0.40

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
SCHEMBL7188013 0.84 PGK1 (0.64) PTPN1PTPN2PTPN6PTPN11PGK1
SCHEMBL7188473 0.81 PTPN1 (0.48) PTPN1PTPN2PTPN6PTPN11PGK1
SCHEMBL7598742 0.81 PTPN1 (0.54) PTPN1PTPN2PTPN6PTPN11PGK1
SCHEMBL7598752 0.76 PTPN1 (0.44) PTPN1PTPN2PTPN6PTPN11PGK1
SCHEMBL7190900 0.76
SCHEMBL7189537 0.73 PTPN1 (0.60) PTPN1PTPN2PGK1PGK2PTPRC
SCHEMBL7188019 0.73 PGK1 (0.57) PTPN1PTPN2PTPN6PTPN11PGK1
SCHEMBL7188031 0.72 PTPN1 (0.52) PTPN1PTPN2PTPN6PTPN11PGK1
SCHEMBL28476733 0.72
SCHEMBL7193692 0.71 PTPN1 (0.48) PTPN1PTPN2PTPN6PTPN11PGK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1268494-A1 SULFUR SUBSTITUTED ARYLDIFLUOROMETHYLPHOSPHONIC ACIDS AS PTP-1B INHIBITORS Merck Frosst Canada & Co. (CA) 2003-01-02 EP disclosed
WO-2001070753-A1 SULFUR SUBSTITUTED ARYLDIFLUOROMETHYLPHOSPHONIC ACIDS AS PTP-1B INHIBITORS MERCK FROSST CANADA & CO. (CA) 2001-09-27 WO disclosed