SCHEMBL6001999

SCHEMBL6001999

CCCCCS(=O)(=O)C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.52
CA2 P00918 5/20 0.50
CES1 P23141 5/20 0.47
CES2 O00748 2/20 0.47
EPHX1 P07099 1/20 0.47

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
SCHEMBL4784060 1.00 FAAH (0.52) FAAHCA2CES1CES2EPHX1
SCHEMBL4076093 0.98 FAAH (0.56) FAAHCA2CES1CES2EPHX1
SCHEMBL23520532 0.98 FAAH (0.56) FAAHCA2CES1CES2EPHX1
SCHEMBL13864077 0.98 FAAH (0.56) FAAHCA2CES1CES2EPHX1
SCHEMBL10002197 0.92 EPHX1 (0.43) FAAHCA2CES1CES2EPHX1
SCHEMBL5469606 0.87 CA2 (0.37) FAAHCA2CES1CES2EPHX1
SCHEMBL5457097 0.84 CA2 (0.37) FAAHCA2CES1CES2EPHX1
SCHEMBL17092516 0.84 CA2 (0.37) FAAHCA2CES1CES2EPHX1
SCHEMBL6895720 0.81 EPHX1 (0.37) FAAHCA2CES1CES2EPHX1
SCHEMBL21414876 0.81 CA1 (0.37) CA2EPHX1

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 FAAH 4379/4885CA2 283/4885CES1 1242/4885

“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.