SCHEMBL7599157

SCHEMBL7599157

O=P(O)(Oc1ccc(CSCc2ccccc2Br)cc1Br)C(F)F

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
STAT3 P40763 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HPGD P15428 3/20 0.34
FFAR4 Q5NUL3 1/20 0.33
KDM4E B2RXH2 1/20 0.32
PDCD1 Q15116 1/20 0.31
CD274 Q9NZQ7 1/20 0.31

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
SCHEMBL7188022 0.91 SMN1; SMN2 (0.39) PTPN1ALDH1A1MAPTSMN1; SMN2HPGD
SCHEMBL7189759 0.90 ALDH1A1 (0.40) PTPN1ALDH1A1MAPTHPGDFFAR4
SCHEMBL7183000 0.90 TP53 (0.38) PTPN1ALDH1A1MAPTSMN1; SMN2HPGD
SCHEMBL7188752 0.90 PTPN1 (0.34) PTPN1
SCHEMBL7599756 0.88 PTPN1 (0.39) PTPN1ALDH1A1MAPTHTTSMN1; SMN2
SCHEMBL7189856 0.88 PTPN1 (0.39) PTPN1FFAR4
SCHEMBL7187615 0.88 CD274 (0.39) PTPN1FFAR4PDCD1CD274
SCHEMBL7186867 0.87 PTPN1 (0.32) PTPN1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL7194652 0.87 CCR5 (0.37) PTPN1ALDH1A1MAPTHTTSMN1; SMN2
SCHEMBL7593824 0.86 FTO (0.37) PTPN1HTTSMN1; SMN2

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-6498151-B2 PROTEIN TYROSINE PHOSPHATASES INHIBITORS, ESPECIALLY AS ANTIDIABETIC AGENTS MERCK FROSST CANADA & CO. (CA) 2002-12-24 US claimed
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

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 13/4885ALDH1A1 312/4885MAPT 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.