SCHEMBL5166709

SCHEMBL5166709

CCOP(=O)(OCC)C(F)(F)c1ccc(CN(C)Cc2ccc(C(F)(F)P(=O)(OCC)OCC)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 1/20 0.41
PTPN1 P18031 7/20 0.38
PTPN2 P17706 4/20 0.37
PTPN6 P29350 4/20 0.37
PTPN11 Q06124 3/20 0.37
PGK1 P00558 1/20 0.37
PGK2 P07205 1/20 0.37
SIGMAR1 Q99720 2/20 0.37
PTPRC P08575 2/20 0.37
PTPRB P23467 2/20 0.37
TMEM97 Q5BJF2 1/20 0.37
CDC25A P30304 1/20 0.37
ACHE P22303 3/20 0.37
NR1I2 O75469 1/20 0.37
LMNA P02545 1/20 0.37
ADRA2A P08913 1/20 0.37
CYP2D6 P10635 1/20 0.37
SLC6A2 P23975 1/20 0.37
HTR2A P28223 1/20 0.37
SLC6A4 P31645 1/20 0.37

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
SCHEMBL5166721 0.85 PTPN1 (0.36) PYCR1PTPN1PTPN2PTPN6PTPN11
SCHEMBL5165292 0.82 PTPN5 (0.44) PTPN1
SCHEMBL7598722 0.81 PTPN1 (0.39) PTPN1PTPN2PTPN6PTPN11PGK1
SCHEMBL14076471 0.81 PTPN1 (0.39) PTPN1PTPN2PTPN6PTPN11PGK1
SCHEMBL7182139 0.81 PTPN1 (0.39) PTPN1PTPN2PTPN6PTPN11PGK1
SCHEMBL5162409 0.81 PTPN1 (0.39) PTPN1PTPN2PTPN6PTPN11PGK1
SCHEMBL5179142 0.80 HDAC1 (0.51) PTPN1LMNAALDH1A1MEN1KMT2A
SCHEMBL24984756 0.79 MAPT (0.41) PTPN1PTPN2PTPN6PTPN11PGK1
SCHEMBL5167139 0.79 HDAC3 (0.52) PTPN1PTPN2PTPN6PTPN11MEN1
Hydrochloric Acid SCHEMBL5165752 0.79 PTPN1 (0.41) PTPN1PTPN2PTPN6PTPN11PGK1

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 PYCR1 323/4885PTPN1 2/4885PTPN2 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.