SCHEMBL5166571

SCHEMBL5166571

COc1ccc(-c2ccc(CN(Cc3ccc(C(F)(F)P(=O)(O)O)c(Cl)c3)S(=O)(=O)c3ccccc3OC)cc2)cc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 13/20 0.47
ALDH1A1 P00352 2/20 0.43
PTPN2 P17706 1/20 0.42
TAS2R14 Q9NYV8 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
IDO1 P14902 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
SCHEMBL5164813 0.94 PTPN1 (0.53) PTPN1ALDH1A1PTPN2TAS2R14
SCHEMBL5163073 0.93 PTPN1 (0.45) PTPN1ALDH1A1PTPN2LMNAMAPT
SCHEMBL5164528 0.92 PTPN1 (0.45) PTPN1ALDH1A1PTPN2TAS2R14LMNA
SCHEMBL5166033 0.88 PTPN1 (0.45) PTPN1ALDH1A1PTPN2TAS2R14
SCHEMBL5165866 0.88 PTPN1 (0.48) PTPN1ALDH1A1PTPN2
SCHEMBL5164627 0.85 PTPN1 (0.44) PTPN1ALDH1A1PTPN2LMNAMAPT
SCHEMBL5166577 0.85 ALDH1A1 (0.41) PTPN1ALDH1A1TAS2R14LMNAMAPT
SCHEMBL5167003 0.84 PTPN5 (0.45) PTPN1PTPN2
SCHEMBL5166610 0.84 PTPN1 (0.43) PTPN1ALDH1A1PTPN2LMNAMAPT
SCHEMBL5892068 0.82 PTPN1 (0.42) PTPN1ALDH1A1PTPN2TAS2R14LMNA

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 2/4885ALDH1A1 3296/4885PTPN2 12/4885

“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.