SCHEMBL3907124

SCHEMBL3907124

Cc1c(-c2cccc(OCC3CCN(C(=O)Nc4ccccc4Cl)CC3)c2)sc(C(=O)O)c1OCC(=O)O

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 16/20 0.68
PTPN2 P17706 5/20 0.65
FAAH O00519 1/20 0.45
GAA P10253 2/20 0.43
TSHR P16473 1/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL3906715 0.93 PTPN1 (0.70) PTPN1PTPN2FAAHGAAALDH1A1
SCHEMBL3913878 0.93 PTPN1 (0.70) PTPN1PTPN2GAA
SCHEMBL3908474 0.91 PTPN1 (0.82) PTPN1PTPN2
SCHEMBL3908364 0.91 PTPN1 (0.67) PTPN1PTPN2
SCHEMBL3909009 0.91 PTPN1 (0.67) PTPN1PTPN2TSHRMAPT
SCHEMBL3906873 0.90 PTPN1 (0.83) PTPN1PTPN2
SCHEMBL3905930 0.90 PTPN1 (0.66) PTPN1PTPN2
SCHEMBL3908946 0.89 PTPN1 (0.65) PTPN1PTPN2
SCHEMBL3915496 0.88 PTPN1 (0.68) PTPN1PTPN2GAA
SCHEMBL3903422 0.88 PTPN1 (0.69) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7521473-B2 Inhibitors of protein tyrosine phosphatase 1B WYETH (US) 2009-04-21 US disclosed
US-20050203087-A1 Inhibitors of protein tyrosine phosphatase 1B WYETH 2005-09-15 US disclosed
WO-2005081954-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE 1B WYETH (US) 2005-09-09 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-20050203087-A1 Inhibitors of protein tyrosine phosphatase 1B PTPRO, PTPRS, PTPRM PTPN1 11/4885PTPN2 17/4885FAAH 3733/4885

“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.