SCHEMBL6002339

SCHEMBL6002339

O=S(=O)(c1ccc(OCc2ccc(SC(F)(F)F)cc2)cc1)C(F)(F)F

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRZ1 P23471 3/20 0.78
CA2 P00918 6/20 0.47
CA1 P00915 5/20 0.47
CA9 Q16790 5/20 0.47
CA12 O43570 4/20 0.47
CA7 P43166 4/20 0.47
CA4 P22748 1/20 0.42
CA5A P35218 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
MMP1 P03956 3/20 0.42
MMP2 P08253 3/20 0.42
MMP9 P14780 3/20 0.42
MMP14 P50281 3/20 0.42
ADAM17 P78536 2/20 0.42
AR P10275 1/20 0.41
PTPN1 P18031 3/20 0.41
PTPN2 P17706 2/20 0.40
PTPRC P08575 1/20 0.40
PTPRB P23467 1/20 0.40
PTPN6 P29350 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
SCHEMBL6000294 0.88 PTPRZ1 (1.00) PTPRZ1CA2CA1CA9CA12
SCHEMBL6685855 0.77 PTPRZ1 (0.77) PTPRZ1PTPN1PTPN2PTPRCPTPRB
Lithium Ion SCHEMBL3275290 0.77 PTPRZ1 (0.70) PTPRZ1PTPN1PTPN2PTPRCPTPN7
SCHEMBL30745864 0.77 PTPRZ1 (0.76) PTPRZ1CA2CA1CA9CA12
SCHEMBL30745904 0.75 PTPRZ1 (0.72) PTPRZ1PTPN1PTPN2PTPRCPTPN7
SCHEMBL3275286 0.75 PTPRZ1 (0.72) PTPRZ1PTPN1PTPN2PTPRCPTPN7
SCHEMBL3274502 0.75 PTPRZ1 (0.72) PTPRZ1MMP1MMP2MMP9MMP14
SCHEMBL6001722 0.73 PTPRZ1 (0.71) PTPRZ1CA2CA1CA9CA12
SCHEMBL3275342 0.73 PTPRZ1 (0.68) PTPRZ1ARPTPN1PTPN2PTPN7
SCHEMBL30885390 0.72 PTPRZ1 (0.67) PTPRZ1PTPN1PTPN2PTPN7MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1212296-B9 PHOSPHATE MIMICS AND METHODS OF TREATMENT USING PHOSPHATASE INHIBITORS SUGEN INC (US) 2006-05-10 EP disclosed
EP-1212296-B1 PHOSPHATE MIMICS AND METHODS OF TREATMENT USING PHOSPHATASE INHIBITORS SUGEN INC (US) 2005-11-09 EP disclosed
US-20040138255-A1 Phosphate mimics and methods of treatment using phosphatease inhibitors SUGEN, INC. 2004-07-15 US disclosed
US-6596772-B1 Relates to trifluoromethyl sulfonyl and trifluoromethyl sulfonamido compounds and the physiologically acceptable salts and the prodrugs thereof. These compounds are expected to modulate the activity of protein tyrosine enzymes which are SUGEN, INC. 2003-07-22 US disclosed
EP-1212296-A1 PHOSPHATE MIMICS AND METHODS OF TREATMENT USING PHOSPHATASE INHIBITORS Sugen, Inc. (US) 2002-06-12 EP disclosed
WO-2001016097-A1 PHOSPHATE MIMICS AND METHODS OF TREATMENT USING PHOSPHATASE INHIBITORS SUGEN, INC. (US) 2001-03-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040138255-A1 Phosphate mimics and methods of treatment using phosphatease inhibitors PPP4C, PTPRO, PTPRS PTPRZ1 52/4885CA2 283/4885CA1 833/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.