SCHEMBL5500754

SCHEMBL5500754

COC(=O)c1ccccc1-c1ccc(-c2cnc(N(Cc3ccc(C(F)(F)P(=O)(O)O)c(Br)c3)c3ccc(Cl)c(Cl)c3)o2)cc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 5/20 0.37
PTPN2 P17706 3/20 0.37
BDKRB1 P46663 4/20 0.36
BRS3 P32247 2/20 0.34
SLC6A3 Q01959 3/20 0.34
SLC6A4 P31645 2/20 0.34
LTB4R2 Q9NPC1 1/20 0.34
FAAH O00519 1/20 0.33
PDK2 Q15119 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
PTPN5 P54829 1/20 0.33

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
SCHEMBL5503152 0.95 PTPN1 (0.35) PTPN1PTPN2BDKRB1BRS3FAAH
SCHEMBL5521865 0.94 PTPN1 (0.35) PTPN1PTPN2BDKRB1BRS3SLC6A3
SCHEMBL5505841 0.92 LTB4R2 (0.35) PTPN1PTPN2BDKRB1BRS3SLC6A3
SCHEMBL5503912 0.92 PTPN1 (0.38) PTPN1PTPN2BRS3LTB4R2RAB9A
SCHEMBL5500052 0.91 PTPN1 (0.37) PTPN1PTPN2FAAHKDM4EPTPN5
SCHEMBL5502946 0.89 PTPN1 (0.35) PTPN1PTPN2KDM4EALDH1A1HPGD
SCHEMBL5502721 0.88 PTPN1 (0.38) PTPN1PTPN2FAAH
SCHEMBL5500025 0.88 PTPN1 (0.40) PTPN1PTPN2PTPN5
SCHEMBL5499218 0.87 PTPN1 (0.37) PTPN1PTPN2RAB9APTPN5
SCHEMBL5500755 0.86 SLC6A3 (0.34) BDKRB1BRS3SLC6A3SLC6A4LTB4R2

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-1786421-A2 OXYGEN/NITROGEN HETEROCYCLE INHIBITORS OF TYROSINE PHOSPHATASES Cengent Therapeutics, Inc. (US) 2007-05-23 EP claimed
US-20060135483-A1 Oxygen/nitrogen heterocycle inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2006-06-22 US claimed
WO-2006017124-A2 OXYGEN/NITROGEN HETEROCYCLE INHIBITORS OF TYROSINE PHOSPHATASES CENGENT THERAPEUTICS, INC. (US) 2006-02-16 WO 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 PTPN1 3/4885PTPN2 24/4885BDKRB1 3825/4885

“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.