SCHEMBL7598709

SCHEMBL7598709

O=P(O)(O)C(F)(F)c1ccc(CSCCCOc2ccccc2)cc1Br

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 17/20 0.53
PTPN2 P17706 7/20 0.50
PTPRC P08575 3/20 0.41
PTPRB P23467 2/20 0.40
PTPN6 P29350 2/20 0.40
PTPN11 Q06124 2/20 0.40
FDPS P14324 1/20 0.40
CDC25A P30304 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38

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
SCHEMBL7194695 0.94 PTPN1 (0.53) PTPN1PTPN2PTPRCPTPRBPTPN6
SCHEMBL7194653 0.94 PTPN1 (0.53) PTPN1PTPN2PTPRCPTPRBPTPN6
SCHEMBL7187785 0.84 PTPN1 (0.54) PTPN1PTPN2PTPRCPTPN6PTPN11
SCHEMBL7187658 0.84 PTPN1 (0.66) PTPN1PTPN2PTPRC
SCHEMBL7192783 0.83 PTPN1 (0.56) PTPN1PTPN2PTPRCPTPRBPTPN6
SCHEMBL7594613 0.83 PTPN1 (0.57) PTPN1PTPN2PTPRCPTPN6PTPN11
SCHEMBL7194654 0.83 PTPN1 (0.41) PTPN1PTPN2PTPRC
SCHEMBL7599748 0.82 PTPN1 (0.65) PTPN1PTPN2PTPRC
SCHEMBL7659253 0.82 PTPN1 (0.70) PTPN1PTPN2PTPRC
SCHEMBL7659065 0.82 PTPN1 (0.56) PTPN1PTPN2PTPRCPTPN6PTPN11

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 13/4885PTPN2 24/4885PTPRC 10/4885

“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.