SCHEMBL7888262

SCHEMBL7888262

NS(=O)(=O)c1ccc(CC(Cc2ccc(OP(=O)(O)C(F)F)cc2)(C(=O)OCc2ccccc2)C(=O)OCc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 5/20 0.56
PTPRC P08575 2/20 0.53
CA2 P00918 13/20 0.44
CA1 P00915 12/20 0.44
CA12 O43570 9/20 0.44
CA9 Q16790 9/20 0.44
CA5A P35218 9/20 0.44
CA4 P22748 8/20 0.44
CA7 P43166 8/20 0.44
CA5B Q9Y2D0 8/20 0.44
PTPRB P23467 1/20 0.40
F2 P00734 1/20 0.40
PLAU P00749 1/20 0.40
PLAT P00750 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
SCHEMBL6950849 0.88 PTPN1 (0.55) PTPN1PTPRC
SCHEMBL6951095 0.85 PTPN1 (0.59) PTPN1PTPRCF2PLAUPLAT
SCHEMBL6946043 0.83 CA2 (0.45) CA2CA1CA12CA9CA5A
SCHEMBL7888258 0.82 PTPN1 (0.81) PTPN1PTPRCCA2CA1PTPRB
SCHEMBL6948365 0.79 PTPN1 (0.49) PTPN1PTPRCF2PLAUPLAT
SCHEMBL6946443 0.78 PTPN1 (0.53) PTPN1PTPRCCA2CA1CA12
SCHEMBL6950094 0.78 PTPN1 (0.48) PTPN1PTPRC
SCHEMBL6952150 0.71 PTPN1 (1.00) PTPN1PTPRCPTPRB
SCHEMBL6952067 0.70 PTPN1 (1.00) PTPN1PTPRCPTPRB
SCHEMBL6951489 0.70 PTPN1 (1.00) PTPN1PTPRCPTPRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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