SCHEMBL7199267

SCHEMBL7199267

CCOP(=O)(OCC)C(F)(F)c1ccc(CSC(C)Cc2ccccc2)cc1Br

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.39
PTPN2 P17706 2/20 0.39
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
POLB P06746 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
EPHX1 P07099 2/20 0.31
LMNA P02545 1/20 0.31
FPR2 P25090 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
SCHEMBL7594241 0.90 PTPN1 (0.37) PTPN1PTPN2ATML3MBTL1MEN1
SCHEMBL7194495 0.85 PTPN1 (0.54) PTPN1PTPN2ATML3MBTL1
SCHEMBL7596371 0.81 PTPN1 (0.53) PTPN1PTPN2ALDH1A1LMNA
SCHEMBL7187448 0.80 PTPN1 (0.47) PTPN1PTPN2L3MBTL1MEN1KMT2A
SCHEMBL7190893 0.79 PTPN1 (0.42) PTPN1PTPN2MEN1KMT2AALDH1A1
SCHEMBL7193271 0.79 PTPN1 (0.47) PTPN1PTPN2MEN1KMT2ANPSR1
SCHEMBL7194718 0.79 PTPN1 (0.40) PTPN1PTPN2MEN1KMT2ANPSR1
SCHEMBL5389579 0.78 PTPN1 (0.43) PTPN1PTPN2MEN1KMT2ANPSR1
SCHEMBL14450414 0.78 PTPN1 (0.49) PTPN1PTPN2
SCHEMBL7592117 0.78 PTPN1 (0.49) PTPN1PTPN2EPHX1

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 24/4885ATM 2651/4885

“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.