SCHEMBL5177656

SCHEMBL5177656

O=P(O)(O)C(F)(F)c1ccc(CN(c2ccc(Cl)c(Cl)c2)S(=O)(=O)c2ccccc2)cc1Br

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.49
PTPN2 P17706 3/20 0.49
RORC P51449 1/20 0.43
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
POLB P06746 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
NR1I2 O75469 2/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
PKM P14618 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
SCHEMBL5166705 0.86 CNR1 (0.42) PTPN1PTPN2RORCMEN1KMT2A
SCHEMBL5166715 0.86 PTPN1 (0.41) PTPN1PTPN2RORCMEN1KMT2A
SCHEMBL5177659 0.78 MEN1 (0.40) RORCMEN1KMT2AL3MBTL1POLB
SCHEMBL5188294 0.77 PTPN1 (0.75) PTPN1PTPN2
SCHEMBL4954605 0.76 GCGR (0.44) PTPN1PTPN2
SCHEMBL5165546 0.75 PTPN1 (0.65) PTPN1PTPN2MEN1KMT2A
SCHEMBL5500025 0.75 PTPN1 (0.40) PTPN1PTPN2
SCHEMBL5188296 0.73 PTPN1 (0.62) PTPN1PTPN2
SCHEMBL4957045 0.73 PTPN1 (0.45) PTPN1PTPN2
SCHEMBL4955538 0.73 PTPN1 (0.52) PTPN1PTPN2TRPM8

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 12/4885RORC 3727/4885

“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.