SCHEMBL7595276

SCHEMBL7595276

CCC(C)OP(=O)(O)C(F)(F)c1ccc(CCCBr)cc1Br

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 13/20 0.39
PTPN2 P17706 6/20 0.39
PTPN6 P29350 1/20 0.33
PTPN11 Q06124 1/20 0.33
PTPRC P08575 2/20 0.32
S1PR4 O95977 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR5 Q9H228 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
SCHEMBL7182093 0.97 PTPN1 (0.40) PTPN1PTPN2PTPN6PTPN11PTPRC
SCHEMBL3736625 0.89 PTPN1 (0.41) PTPN1PTPN2PTPRC
Hydrochloric Acid SCHEMBL3800607 0.87 PTPN1 (0.39) PTPN1PTPN2PTPRC
SCHEMBL3741682 0.86 PTPN1 (0.41) PTPN1PTPN2PTPRC
SCHEMBL3735418 0.85 PTPN1 (0.37) PTPN1PTPN2PTPRCS1PR1
SCHEMBL3736018 0.85 PTPN1 (0.39) PTPN1PTPN2PTPRC
SCHEMBL3743057 0.83 PTPN1 (0.40) PTPN1PTPN2PTPRCS1PR1
SCHEMBL3732885 0.83 PTPN1 (0.41) PTPN1PTPN2PTPRC
SCHEMBL3735483 0.83 PTPN1 (0.43) PTPN1PTPN2
SCHEMBL3742981 0.83 PTPN1 (0.51) 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 2 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 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 24/4885PTPN6 12/4885

“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.