SCHEMBL4643306

SCHEMBL4643306

O=C1CN(c2cc(Br)ccc2OCc2ccccc2)S(=O)(=O)N1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.53
SLC6A4 P31645 1/20 0.45
USP28 Q96RU2 1/20 0.44
USP25 Q9UHP3 1/20 0.44
PTP4A3 O75365 1/20 0.43
HTT P42858 2/20 0.43
CCR5 P51681 3/20 0.43
PTGER1 P34995 4/20 0.42
CYP1A2 P05177 1/20 0.42
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RAB9A P51151 1/20 0.41
PTPN2 P17706 1/20 0.40

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
SCHEMBL629845 0.88 PTPN1 (0.46) PTPN1SLC6A4USP28USP25PTP4A3
SCHEMBL3006427 0.88 PTPN1 (0.46) PTPN1SLC6A4USP28USP25PTP4A3
SCHEMBL4646906 0.86 PTPN1 (0.53) PTPN1SLC6A4SMN1; SMN2RAB9APTPN2
SCHEMBL4646378 0.84 PTPN1 (0.51) PTPN1PTGER1CYP1A2PTPN2
SCHEMBL4647040 0.84 PTPN1 (0.50) PTPN1SLC6A4ALDH1A1SMN1; SMN2
Potassium SCHEMBL4647048 0.84 PTPN1 (0.50) PTPN1SLC6A4ALDH1A1SMN1; SMN2
SCHEMBL3006552 0.83 PTPN1 (0.44) PTPN1SLC6A4PTP4A3CCR5PTGER1
SCHEMBL4643501 0.82 PTPN1 (0.62) PTPN1SLC6A4PTP4A3
SCHEMBL4646366 0.81 PTPN1 (0.61) PTPN1SLC6A4PTP4A3
SCHEMBL630221 0.81 PTPN1 (0.49) PTPN1

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-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
EP-1960377-A1 l , l , 3-TRI0X0-l , 2 , 5-THIADIAZ0LIDINES AND THEIR USE AS PTP-ASES INHIBITORS Novartis AG (CH) 2008-08-27 EP disclosed
WO-2007067614-A1 l, l, 3-TRI0X0-l, 2, 5-THIADIAZ0LIDINES AND THEIR USE AS PTP-ASES INHIBITORS NOVARTIS AG (CH) 2007-06-14 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-20080293782-A1 1,1,3-Trioxo-1,2,5-Thiadiazolidines and Their Use as Ptp-Ases Inhibitors PTPRS, IRS1, PTPMT1 PTPN1 10/4885SLC6A4 3509/4885USP28 2138/4885

“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.