SCHEMBL7188299

SCHEMBL7188299

O=P(O)(O)C(F)(F)c1ccc(CSc2cccc(Br)c2)cc1Br

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 12/20 0.51
PTPN2 P17706 3/20 0.48
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
PTPRC P08575 3/20 0.41
PGK1 P00558 2/20 0.39
PGK2 P07205 2/20 0.39
ALDH1A1 P00352 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
SCHEMBL7190972 0.88 PTPN1 (0.49) PTPN1PTPN2MAPTHTTPTPRC
SCHEMBL7594076 0.86 PTPN1 (0.55) PTPN1PTPN2MAPTHTTPTPRC
SCHEMBL7180251 0.86 PTPN1 (0.45) PTPN1PTPN2MAPTHTTPTPRC
SCHEMBL7191434 0.85 PTPN1 (0.44) PTPN1PTPN2MAPTHTTPTPRC
SCHEMBL7595441 0.85 PTPN1 (0.61) PTPN1PTPN2PTPRCPGK1PGK2
SCHEMBL7185478 0.83 PTPN1 (0.48) PTPN1PTPN2PTPRC
SCHEMBL7182937 0.82 PTPN1 (0.58) PTPN1PTPN2PTPRC
SCHEMBL7197816 0.82 PTPN1 (0.52) PTPN1PTPN2MAPTPTPRCALDH1A1
SCHEMBL7186693 0.82 PTPN1 (0.52) PTPN1PTPN2PTPRC
SCHEMBL7199439 0.82 PTPN1 (0.48) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6498151-B2 PROTEIN TYROSINE PHOSPHATASES INHIBITORS, ESPECIALLY AS ANTIDIABETIC AGENTS MERCK FROSST CANADA & CO. (CA) 2002-12-24 US claimed
EP-1268494-A1 SULFUR SUBSTITUTED ARYLDIFLUOROMETHYLPHOSPHONIC ACIDS AS PTP-1B INHIBITORS Merck Frosst Canada & Co. (CA) 2003-01-02 EP disclosed
US-6498151-B2 PROTEIN TYROSINE PHOSPHATASES INHIBITORS, ESPECIALLY AS ANTIDIABETIC AGENTS MERCK FROSST CANADA & CO. (CA) 2002-12-24 US disclosed
US-20020091104-A1 Aryldifluoromethylphosphonic acids with sulfur-containing substituents as PTP-1B inhibitors MERCK FROSST CANADA LTD. (CA) 2002-07-11 US disclosed
WO-2001070753-A1 SULFUR SUBSTITUTED ARYLDIFLUOROMETHYLPHOSPHONIC ACIDS AS PTP-1B INHIBITORS MERCK FROSST CANADA & CO. (CA) 2001-09-27 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-20020091104-A1 Aryldifluoromethylphosphonic acids with sulfur-containing substituents as PTP-1B inhibitors PTPRF, PTPRS, PTPRO PTPN1 13/4885PTPN2 24/4885MAPT 4057/4885

“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.