SCHEMBL5398161

SCHEMBL5398161

CCc1cc(C(F)(F)P(=O)(O)O)c(Br)c(CC)c1COCc1ccc(S(C)(=O)=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 16/20 0.43
PTPN2 P17706 5/20 0.39
PTPN6 P29350 4/20 0.39
PTPRC P08575 4/20 0.34
PTPRB P23467 3/20 0.34
PTPN11 Q06124 3/20 0.34
CDC25A P30304 1/20 0.34
RORC P51449 1/20 0.33

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
SCHEMBL5398144 0.84 PTPN1 (0.40) PTPN1PTPN2PTPN6PTPRCPTPRB
SCHEMBL5394413 0.83 PTPN1 (0.42) PTPN1PTPN2PTPN6PTPRCPTPRB
SCHEMBL5393729 0.81 PTPN1 (0.51) PTPN1PTPN2PTPN6PTPRCPTPRB
SCHEMBL5401089 0.78 CETP (0.44) PTPN1PTPN2PTPN6PTPRBPTPN11
SCHEMBL5414196 0.78 PTPN1 (0.39) PTPN1PTPN2PTPN6PTPRCPTPRB
SCHEMBL5391918 0.73 PGK1 (0.42) PTPN1PTPN2PTPRC
SCHEMBL5404370 0.73 PGK1 (0.42) PTPN1PTPN2PTPRC
SCHEMBL5389583 0.71 PTPN1 (0.40) PTPN1PTPN2PTPRC
SCHEMBL5399352 0.70 PTPN1 (0.46) PTPN1PTPN2
SCHEMBL5404860 0.70 PTPN1 (0.51) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7163932-B2 Aryldifluoromethylphosphonic acids for treatment of diabetes MERCK FROSST CANADA & CO. (CA) 2007-01-16 US disclosed
US-20040176330-A1 Aryldifluoromethylphosphonic acids for treatment of diabetes MERCK FROSST CANADA LTD. (CA) 2004-09-09 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-20040176330-A1 Aryldifluoromethylphosphonic acids for treatment of diabetes PTPRF, PTPRO, PTP4A1 PTPN1 16/4885PTPN2 27/4885PTPN6 15/4885

“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.