SCHEMBL23947952

SCHEMBL23947952

O=C(CC[C@H](NC(=O)c1ccc(-c2ccccc2)cc1)C(=O)Nc1ccc2[nH]cc(C(=O)O)c(=O)c2c1)OCc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN22 Q9Y2R2 1/20 0.66
F10 P00742 1/20 0.48
PRSS1 P07477 1/20 0.48
PLAU P00749 1/20 0.45
PLAUR Q03405 1/20 0.45
ERAP1 Q9NZ08 4/20 0.43
ERAP2 Q6P179 4/20 0.42
IL1RN P18510 1/20 0.42
LNPEP Q9UIQ6 4/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
MDH2 P40926 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CTSL P07711 2/20 0.40
CTSB P07858 2/20 0.40
CTSS P25774 2/20 0.40
TACR1 P25103 5/20 0.40
CTSK P43235 1/20 0.40
HDAC8 Q9BY41 3/20 0.39
HDAC3 O15379 2/20 0.39

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
SCHEMBL23947991 0.92 PTPN22 (0.68) PTPN22F10PRSS1PLAUPLAUR
SCHEMBL23947343 0.89 PTPN22 (0.74) PTPN22F10PLAUPLAURCTSL
SCHEMBL23947993 0.87 PTPN22 (0.72) PTPN22F10PLAUPLAURCTSL
SCHEMBL23947371 0.86 PTPN22 (0.75) PTPN22PLAUPLAURCTSLCTSB
SCHEMBL23948060 0.84 PTPN22 (0.79) PTPN22PLAUPLAURCTSLCTSB
SCHEMBL23947423 0.84 PTPN22 (0.78) PTPN22PLAUPLAURCTSLCTSB
SCHEMBL23947992 0.83 PTPN22 (0.77) PTPN22PLAUPLAURCTSLCTSB
SCHEMBL23947424 0.83 PTPN22 (0.77) PTPN22PLAUPLAURCTSLCTSB
SCHEMBL23947990 0.83 PTPN22 (0.77) PTPN22PLAUPLAURCTSLCTSB
SCHEMBL23947934 0.83 PTPN22 (0.71) PTPN22PLAUPLAURERAP1ERAP2

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
WO-2021211191-A1 NOVEL LYMPHOID-SPECIFIC TYROSINE PHOSPHATASE (LYP) INHIBITORS PURDUE RESEARCH FOUNDATION (US) 2021-10-21 WO disclosed
US-20210323926-A1 Novel Lymphoid-Specific Tyrosine Phosphatase (LYP) Inhibitors PURDUE RESEARCH FOUNDATION (US) 2021-10-21 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-20210323926-A1 Novel Lymphoid-Specific Tyrosine Phosphatase (LYP) Inhibitors PTPN22, PTPN1, PTPRCAP PTPN22 1/4885F10 4505/4885PRSS1 1813/4885

“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.