SCHEMBL5508633

SCHEMBL5508633

O=C(O)c1cccc(Oc2cccc(-c3nnc(N(Cc4ccc(C(F)(F)P(=O)(O)O)cc4)c4ccc(Cl)c(Cl)c4)o3)c2)c1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN5 P54829 8/20 0.43
KMO O15229 1/20 0.42
PTPN1 P18031 8/20 0.38
PTPN2 P17706 1/20 0.38
PTPRB P23467 1/20 0.38
PTPN6 P29350 1/20 0.38
PTPN11 Q06124 1/20 0.38
PLAU P00749 1/20 0.36
LPAR1 Q92633 1/20 0.35
THRB P10828 1/20 0.35

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
SCHEMBL5505414 0.95 PTPN5 (0.40) PTPN5KMOPTPN1PTPN2PTPRB
SCHEMBL5508244 0.92 PTPN5 (0.42) PTPN5PTPN1PTPN2PTPRBPTPN6
SCHEMBL5987596 0.90 KMO (0.50) KMOPLAULPAR1
SCHEMBL5505306 0.89 PTPN1 (0.39) PTPN5KMOPTPN1PTPN2PLAU
SCHEMBL5508632 0.86 KMO (0.43) KMOPLAULPAR1
SCHEMBL5507376 0.85 NR1H2 (0.38) KMOPTPN1PTPN2THRB
SCHEMBL5506735 0.84 PTPN1 (0.43) PTPN5PTPN1PTPN2PTPRBPTPN6
SCHEMBL5509847 0.83 CETP (0.38) THRB
SCHEMBL5505410 0.81 KMO (0.39) KMOLPAR1
SCHEMBL5501676 0.81 NR1H2 (0.38) PTPN1PTPN2THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060135483-A1 Oxygen/nitrogen heterocycle inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2006-06-22 US claimed
EP-1786421-A2 OXYGEN/NITROGEN HETEROCYCLE INHIBITORS OF TYROSINE PHOSPHATASES Cengent Therapeutics, Inc. (US) 2007-05-23 EP disclosed
US-20060135483-A1 Oxygen/nitrogen heterocycle inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2006-06-22 US disclosed
WO-2006017124-A2 OXYGEN/NITROGEN HETEROCYCLE INHIBITORS OF TYROSINE PHOSPHATASES CENGENT THERAPEUTICS, INC. (US) 2006-02-16 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-20060135483-A1 Oxygen/nitrogen heterocycle inhibitors of tyrosine phosphatases PTPRO, PTPRG, PTPN1 PTPN5 17/4885KMO 1058/4885PTPN1 3/4885

“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.