SCHEMBL7193271

SCHEMBL7193271

CCOP(=O)(OCC)C(F)(F)c1ccc(CSCc2ccc(F)cc2)cc1Br

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.47
PTPN2 P17706 2/20 0.35
LMNA P02545 3/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 2/20 0.33
GAA P10253 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL7187448 0.91 PTPN1 (0.47) PTPN1PTPN2LMNAGAAKMT2A
SCHEMBL7596371 0.88 PTPN1 (0.53) PTPN1PTPN2LMNAALDH1A1KDM4E
SCHEMBL7190893 0.83 PTPN1 (0.42) PTPN1PTPN2LMNAALDH1A1KDM4E
SCHEMBL7198599 0.83 PTPN1 (0.43) PTPN1PTPN2LMNAALDH1A1KDM4E
SCHEMBL3733049 0.83 PTPN1 (0.38) PTPN1PTPN2GAA
SCHEMBL3741679 0.83 PTPN1 (0.41) PTPN1PTPN2LMNA
SCHEMBL7194718 0.83 PTPN1 (0.40) PTPN1PTPN2ALDH1A1KDM4EGAA
SCHEMBL27696008 0.82 PTPN1 (0.40) PTPN1PTPN2
SCHEMBL7193733 0.81 PTPN1 (0.49) PTPN1PTPN2ALDH1A1GAAKMT2A
SCHEMBL7193731 0.81 PTPN1 (0.64) PTPN1PTPN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 24/4885LMNA 4857/4885

“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.