SCHEMBL5166246

SCHEMBL5166246

CCOP(=O)(OCC)C(F)(F)c1ccc(CN(Cc2ccc(C(F)(F)P(=O)(O)OC(C)CC)c(Br)c2)S(=O)(=O)c2ccc3ccccc3c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 18/20 0.47
PTPN2 P17706 2/20 0.47
CNR2 P34972 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA9 Q16790 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
SCHEMBL5165963 0.93 PTPN1 (0.49) PTPN1PTPN2
SCHEMBL5166237 0.89 PTPN1 (0.50) PTPN1PTPN2CNR2CA12CA1
SCHEMBL5165954 0.81 PTPN1 (0.53) PTPN1PTPN2CNR2
SCHEMBL5892036 0.80 PTPN1 (0.60) PTPN1PTPN2
SCHEMBL5167247 0.76 PTPN1 (0.42) PTPN1
SCHEMBL5165519 0.76 PTPN1 (0.42) PTPN1
SCHEMBL3732885 0.74 PTPN1 (0.41) PTPN1PTPN2
SCHEMBL3736018 0.73 PTPN1 (0.39) PTPN1PTPN2
SCHEMBL5166721 0.73 PTPN1 (0.36) PTPN1PTPN2
SCHEMBL3741682 0.73 PTPN1 (0.41) PTPN1PTPN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1765332-A2 TRISUBSTITUTED NITROGEN MODULATORS OF TYROSINE PHOSPHATASES Cengent Therapeutics, Inc. (US) 2007-03-28 EP disclosed
US-20060135773-A1 Trisubstituted nitrogen modulators of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2006-06-22 US disclosed
WO-2006009876-A2 TRISUBSTITUTED NITROGEN MODULATORS OF TYROSINE PHOSPHATASES CENGENT THERAPEUTICS, INC. (US) 2006-01-26 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-20060135773-A1 Trisubstituted nitrogen modulators of tyrosine phosphatases PTPA, PTPN1, PTPRS PTPN1 2/4885PTPN2 12/4885CNR2 4188/4885

“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.