SCHEMBL3213221

SCHEMBL3213221

N#CCCCCn1cc(-c2ccc(O)c(N3CC(=O)NS3(=O)=O)c2)cn1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 7/20 0.48
ABL1 P00519 1/20 0.34
FLT3 P36888 3/20 0.34
JAK2 O60674 2/20 0.33
JAK1 P23458 2/20 0.33
PRMT5 O14744 2/20 0.32
WDR77 Q9BQA1 2/20 0.32
USP30 Q70CQ3 1/20 0.31
CTSK P43235 1/20 0.31
CTSC P53634 1/20 0.31
PTPN2 P17706 2/20 0.31
KDM5A P29375 1/20 0.31
MET P08581 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
SCHEMBL3262939 0.97 PTPN1 (0.48) PTPN1ABL1FLT3JAK2JAK1
SCHEMBL2936203 0.86 PTPN1 (0.48) PTPN1JAK2JAK1PRMT5WDR77
SCHEMBL3213594 0.85 PTPN1 (0.53) PTPN1FLT3PRMT5WDR77CTSK
SCHEMBL3220712 0.84 PTPN1 (0.48) PTPN1ABL1PRMT5WDR77PTPN2
SCHEMBL2937480 0.84 PTPN1 (0.50) PTPN1PRMT5WDR77PTPN2
SCHEMBL31328076 0.84 PTPN1 (0.50) PTPN1PRMT5WDR77PTPN2
SCHEMBL3226584 0.82 PTPN1 (0.52) PTPN1FLT3JAK2PRMT5WDR77
SCHEMBL2936717 0.82 PTPN1 (0.44) PTPN1
SCHEMBL2930306 0.80 PTPN1 (0.58) PTPN1PRMT5WDR77USP30PTPN2
SCHEMBL3201397 0.77 PTPN1 (0.53) PTPN1FLT3PRMT5WDR77CTSK

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
US-20080293782-A1 1,1,3-Trioxo-1,2,5-Thiadiazolidines and Their Use as Ptp-Ases Inhibitors NOVARTIS AG (CH) 2008-11-27 US claimed
US-20100305036-A1 COMBINATION OF PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND HUMAN GROWTH HORMONE FOR THE TREATMENT OF MUSCLE ATROPHY AND RELATED DISORDERS NOVARTIS AG (SZ) 2010-12-02 US disclosed
US-20100035860-A1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE FOR THE PROMOTION OF PHYSIOLOGICAL CARDIAC HYPERTROPHY JEYASEELAN JEY RAJU 2010-02-11 US disclosed
US-20080293782-A1 1,1,3-Trioxo-1,2,5-Thiadiazolidines and Their Use as Ptp-Ases Inhibitors NOVARTIS AG (CH) 2008-11-27 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 (3 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-20080293782-A1 1,1,3-Trioxo-1,2,5-Thiadiazolidines and Their Use as Ptp-Ases Inhibitors PTPRS, IRS1, PTPMT1 PTPN1 10/4885ABL1 698/4885FLT3 2477/4885
US-20100305036-A1 COMBINATION OF PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND HUMAN GROWTH HORMONE FOR THE TREATMENT OF MUSCLE ATROPHY AND RELATED DISORDERS MUSK, PPP5C, PPP3CA PTPN1 35/4885ABL1 88/4885FLT3 1117/4885
US-20100035860-A1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE FOR THE PROMOTION OF PHYSIOLOGICAL CARDIAC HYPERTROPHY PPM1A, TNNI3, PTPA PTPN1 41/4885ABL1 112/4885FLT3 1201/4885

“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.