SCHEMBL7840352

SCHEMBL7840352

CC(C)OCC(COC(C)C)(Cc1ccc(C(F)(F)P(=O)(OC(C)(C)C)OC(C)(C)C)cc1)Cc1ccc(C(F)(F)P(=O)(OC(C)(C)C)OC(C)(C)C)cc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 15/20 0.43
PTPN5 P54829 3/20 0.34
PTPRC P08575 4/20 0.33
PTPN2 P17706 5/20 0.33
PTPN6 P29350 5/20 0.33
PTPN11 Q06124 4/20 0.33
PTPRB P23467 3/20 0.33
CDC25A P30304 1/20 0.33
PGK1 P00558 1/20 0.33
PGK2 P07205 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
SCHEMBL6941207 0.83 PTPN1 (0.62) PTPN1PTPN5PTPRCPTPN2PTPN6
SCHEMBL6941229 0.81 PTPN1 (0.41) PTPN1PTPRCPTPN2PTPN6PTPN11
SCHEMBL6943956 0.75 PTPN1 (0.39) PTPN1PTPN5PTPRCPTPN2PTPN6
SCHEMBL6941175 0.75 PTPN1 (0.59) PTPN1PTPRCPTPN2PTPN6PTPN11
SCHEMBL6944028 0.74 PTPN1 (0.52) PTPN1PTPN5PTPRCPTPN2PTPN6
SCHEMBL6946050 0.74 PTPN1 (0.52) PTPN1PTPRCPTPN2PTPN6PTPN11
SCHEMBL6944034 0.73 PTPN1 (0.51) PTPN1PTPN5PTPRCPTPN2PTPN6
SCHEMBL7886902 0.72 PTPN1 (0.43) PTPN1PTPRCPTPN2PTPN6
SCHEMBL7592325 0.72 PTPN1 (0.50) PTPN1PTPRCPTPN2PTPN6PTPN11
SCHEMBL7886828 0.72 PTPN1 (0.55) PTPN1PTPRC

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-1115729-A1 PHOSPHONIC ACID DERIVATIVES AS INHIBITORS OF PTP-1B Merck Frosst Canada & Co. (CA) 2001-07-18 EP disclosed
WO-2000017211-A1 PHOSPHONIC ACIDS DERIVATIVES AS INHIBITORS OF PTP-1B MERCK FROSST CANADA & CO. (CA) 2000-03-30 WO disclosed