SCHEMBL6947737

SCHEMBL6947737

O=C(O)C(Cc1ccc(C(F)(F)P(=O)(O)O)cc1)(Cc1ccc(C(F)(F)P(=O)(O)O)cc1)C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 16/20 0.76
PTPRC P08575 3/20 0.66
PTPN2 P17706 4/20 0.60
PTPN6 P29350 4/20 0.60
PTPN11 Q06124 3/20 0.60
PGK1 P00558 2/20 0.60
PGK2 P07205 2/20 0.60
PTPN5 P54829 1/20 0.54
PTPRB P23467 2/20 0.54
CDC25A P30304 1/20 0.54

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
SCHEMBL6946496 0.97 PTPN1 (0.76) PTPN1PTPRCPTPN2PTPN6PTPN11
SCHEMBL6946492 0.93 PGK1 (0.74) PTPN1PTPRCPTPN2PTPN6PTPN11
SCHEMBL6944215 0.93 PTPN1 (0.67) PTPN1PTPRCPTPN2PTPN6PTPN11
SCHEMBL6951072 0.88 PTPN1 (0.65) PTPN1PTPRCPTPN2PTPN6PTPN11
SCHEMBL6949964 0.88 PTPN1 (0.72) PTPN1PTPRCPTPN2PTPN6PTPN11
SCHEMBL6947267 0.87 PTPN1 (1.00) PTPN1PTPRCPTPN2PTPN6PTPN11
SCHEMBL6944081 0.87 PTPN1 (0.64) PTPN1PTPRCPTPN2PTPN6PTPN11
SCHEMBL6946525 0.84 PTPN1 (0.64) PTPN1PTPRCPTPN2PTPN6PTPN11
SCHEMBL6951489 0.80 PTPN1 (1.00) PTPN1PTPRCPTPN2PTPN6PTPN11
SCHEMBL6952067 0.80 PTPN1 (1.00) PTPN1PTPRCPTPN2PTPN6PTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1115729-B1 PHOSPHONIC ACID DERIVATIVES AS INHIBITORS OF PTP-1B MERCK FROSST CANADA INC (CA) 2003-02-19 EP claimed
EP-1115729-A1 PHOSPHONIC ACID DERIVATIVES AS INHIBITORS OF PTP-1B Merck Frosst Canada & Co. (CA) 2001-07-18 EP claimed
US-6174874-B1 ANTIDIABETIC,-CARCINOGENIC AGENTS; IMPROVING GLUCOSE TOLERANCE/INSULIN-SENSITIVITY; PREVENTING/TREATING OBESITY AND NEURODEGENERATIVE DISEASES; E.G. 1,3-BIS-((PHOSPHONODI-FLUOROMETHYL)PHENYL)-2-DICARBOXYPROPANE MERCK FROSST CANADA & CO. (CA) 2001-01-16 US claimed
WO-2000017211-A1 PHOSPHONIC ACIDS DERIVATIVES AS INHIBITORS OF PTP-1B MERCK FROSST CANADA & CO. (CA) 2000-03-30 WO claimed
EP-1115729-B1 PHOSPHONIC ACID DERIVATIVES AS INHIBITORS OF PTP-1B MERCK FROSST CANADA INC (CA) 2003-02-19 EP disclosed
EP-1115729-A1 PHOSPHONIC ACID DERIVATIVES AS INHIBITORS OF PTP-1B Merck Frosst Canada & Co. (CA) 2001-07-18 EP disclosed
US-6174874-B1 ANTIDIABETIC,-CARCINOGENIC AGENTS; IMPROVING GLUCOSE TOLERANCE/INSULIN-SENSITIVITY; PREVENTING/TREATING OBESITY AND NEURODEGENERATIVE DISEASES; E.G. 1,3-BIS-((PHOSPHONODI-FLUOROMETHYL)PHENYL)-2-DICARBOXYPROPANE MERCK FROSST CANADA & CO. (CA) 2001-01-16 US disclosed
WO-2000017211-A1 PHOSPHONIC ACIDS DERIVATIVES AS INHIBITORS OF PTP-1B MERCK FROSST CANADA & CO. (CA) 2000-03-30 WO disclosed