SCHEMBL19480545

SCHEMBL19480545

CNC(=O)[C@H](Cc1ccc(C(F)(F)P(=O)(O)O)c(Br)c1)NS(C)(=O)=O

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 18/20 0.51
PTPN2 P17706 4/20 0.51
PTPRC P08575 2/20 0.38
MAPT P10636 1/20 0.36

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
SCHEMBL3729935 1.00 PTPN1 (0.51) PTPN1PTPN2PTPRCMAPT
SCHEMBL4001887 0.91 PTPN1 (0.50) PTPN1PTPN2PTPRCMAPT
SCHEMBL3737621 0.88 PTPN1 (0.52) PTPN1PTPN2PTPRC
SCHEMBL29758794 0.88 PTPN1 (0.52) PTPN1PTPN2PTPRC
SCHEMBL3735601 0.87 PTPN1 (0.50) PTPN1PTPN2PTPRC
SCHEMBL4863123 0.78 F10 (0.38) MAPT
SCHEMBL4863118 0.78 MMP9 (0.38) PTPN1PTPN2
SCHEMBL3739161 0.77 PTPN1 (0.42) PTPN1PTPN2MAPT
SCHEMBL3735632 0.76 PTPN1 (0.39) PTPN1PTPN2
SCHEMBL27715841 0.74 PTPN1 (0.60) PTPN1PTPN2PTPRC

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
US-11660306-B2 Treatment of Rett syndrome COLD SPRING HARBOR LABORATORY (US) 2023-05-30 US disclosed
US-20190247408-A1 TREATMENT OF RETT SYNDROME COLD SPRING HARBOR LABORATORY (US) 2019-08-15 US disclosed
US-20170296561-A1 TREATMENT OF RETT SYNDROME COLD SPRING HARBOR LABORATORY 2017-10-19 US 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 (3 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-20190247408-A1 TREATMENT OF RETT SYNDROME MECP2, BDNF, NTRK2 PTPN1 4223/4885PTPN2 3963/4885PTPRC 2835/4885
US-11660306-B2 Treatment of Rett syndrome MECP2, BDNF, NTRK2 PTPN1 4223/4885PTPN2 3963/4885PTPRC 2835/4885
US-20170296561-A1 TREATMENT OF RETT SYNDROME MECP2, BDNF, GRIN2A PTPN1 3602/4885PTPN2 3321/4885PTPRC 1797/4885

“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.