SCHEMBL3220712

SCHEMBL3220712

O=C1CN(c2cc(-c3cnn(CCCC(F)(F)F)c3)ccc2O)S(=O)(=O)N1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.48
MGAT2 Q10469 3/20 0.34
PTPN2 P17706 7/20 0.33
GSK3B P49841 1/20 0.33
DYRK1A Q13627 1/20 0.33
ABL1 P00519 1/20 0.33
SCD5 Q86SK9 1/20 0.33
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
LIPC P11150 1/20 0.32
MOGAT2 Q3SYC2 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
SCHEMBL3213594 0.85 PTPN1 (0.53) PTPN1PTPN2DYRK1APRMT5WDR77
SCHEMBL2936203 0.85 PTPN1 (0.48) PTPN1PRMT5WDR77
SCHEMBL3262939 0.85 PTPN1 (0.48) PTPN1PTPN2ABL1PRMT5WDR77
SCHEMBL3213221 0.84 PTPN1 (0.48) PTPN1PTPN2ABL1PRMT5WDR77
SCHEMBL31328076 0.83 PTPN1 (0.50) PTPN1PTPN2PRMT5WDR77
SCHEMBL2937480 0.83 PTPN1 (0.50) PTPN1PTPN2PRMT5WDR77
SCHEMBL2930306 0.81 PTPN1 (0.58) PTPN1PTPN2PRMT5WDR77
SCHEMBL3226584 0.81 PTPN1 (0.52) PTPN1PTPN2PRMT5WDR77LIPC
SCHEMBL2936717 0.81 PTPN1 (0.44) PTPN1
SCHEMBL27753573 0.80 GSK3B (0.33) MGAT2GSK3BDYRK1ASCD5LIPC

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 6 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
EP-2089026-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE FOR THE PROMOTION OF PHYSIOLOGICAL CARDIAC HYPERTROPHY Novartis AG (CH) 2009-08-19 EP 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
WO-2008070552-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE FOR THE PROMOTION OF PHYSIOLOGICAL CARDIAC HYPERTROPHY NOVARTIS AG (CH) 2008-06-12 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 (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 10/4885MGAT2 3674/4885PTPN2 9/4885
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 35/4885MGAT2 3762/4885PTPN2 49/4885
US-20100035860-A1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE FOR THE PROMOTION OF PHYSIOLOGICAL CARDIAC HYPERTROPHY PPM1A, TNNI3, PTPA PTPN1 41/4885MGAT2 3907/4885PTPN2 39/4885

“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.