SCHEMBL4643501

SCHEMBL4643501

O=C1CN(c2cc(-c3ccc(CO)cc3)ccc2OCc2ccccc2)S(=O)(=O)N1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 7/20 0.62
PTP4A3 O75365 1/20 0.38
PIK3CD O00329 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
SNRNP200 O75643 1/20 0.37
SMPD1 P17405 1/20 0.36
GSTP1 P09211 2/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
FFAR4 Q5NUL3 1/20 0.35
AVPR2 P30518 1/20 0.35
AVPR1A P37288 1/20 0.35
HTR1A P08908 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35

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
SCHEMBL4646708 0.90 PTPN1 (0.60) PTPN1PTP4A3MRGPRX4SMPD1RXRA
SCHEMBL4644677 0.86 PTPN1 (0.52) PTPN1MRGPRX4SMPD1RXRARXRB
SCHEMBL4646366 0.85 PTPN1 (0.61) PTPN1PTP4A3MRGPRX4SNRNP200HTR1A
SCHEMBL4648546 0.84 PTPN1 (0.57) PTPN1PTP4A3SNRNP200HTR1ASLC6A2
SCHEMBL4646906 0.84 PTPN1 (0.53) PTPN1SNRNP200FFAR4HTR1ASLC6A2
SCHEMBL3920457 0.84 PTPN1 (0.61) PTPN1PTP4A3MRGPRX4SNRNP200GSTP1
SCHEMBL4646595 0.83 PTPN1 (0.53) PTPN1MRGPRX4SNRNP200FFAR4AVPR2
SCHEMBL4643306 0.82 PTPN1 (0.53) PTPN1PTP4A3SLC6A4
SCHEMBL4646706 0.80 PTPN1 (0.57) PTPN1PTP4A3MRGPRX4SNRNP200
SCHEMBL4957526 0.79 PTPN1 (0.52) PTPN1MRGPRX4

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 10/4885PTP4A3 59/4885PIK3CD 272/4885

“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.