SCHEMBL6948696

SCHEMBL6948696

CSc1ccc(C(=O)C(Cc2ccc(OP(=O)(O)C(F)F)cc2)(Cc2ccc(C(F)(F)P(=O)(O)O)cc2)c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 17/20 0.61
PTPRC P08575 4/20 0.50
PTPN2 P17706 2/20 0.40
PTPRB P23467 1/20 0.39
PTPN6 P29350 1/20 0.39
CDC25A P30304 1/20 0.39
PTPN11 Q06124 1/20 0.39

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
SCHEMBL6944056 0.97 PTPN1 (0.62) PTPN1PTPRCPTPN2PTPRBPTPN6
SCHEMBL6952226 0.94 PTPN1 (0.53) PTPN1PTPRCPTPN2PTPRBPTPN6
SCHEMBL7884360 0.91 PTPN1 (0.75) PTPN1PTPRCPTPN2PTPRBPTPN6
SCHEMBL6952178 0.89 PTPN1 (0.52) PTPN1PTPRCPTPN2PTPRBPTPN6
SCHEMBL6948687 0.89 PTPN1 (0.78) PTPN1PTPRCPTPN2PTPN6PTPN11
SCHEMBL6944053 0.86 PTPN1 (0.80) PTPN1PTPRCPTPN2PTPN6PTPN11
SCHEMBL6948321 0.84 PTPN1 (0.61) PTPN1PTPRC
SCHEMBL7167844 0.82 PTPN1 (0.53) PTPN1PTPRCPTPN2PTPRBPTPN6
SCHEMBL6951721 0.82 PTPN1 (0.65) PTPN1PTPRCPTPN2PTPRBPTPN6
SCHEMBL7186681 0.81 PTPN1 (0.52) PTPN1PTPRCPTPN2PTPRBPTPN6

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