SCHEMBL4646378

SCHEMBL4646378

Cc1cc(OCc2ccccc2)c(N2CC(=O)NS2(=O)=O)cc1Br

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 9/20 0.51
MAPK14 Q16539 3/20 0.40
BRD4 O60885 1/20 0.39
PTPN2 P17706 1/20 0.38
PTGER1 P34995 3/20 0.37
CYP1A2 P05177 1/20 0.37
SNRNP200 O75643 1/20 0.37
HTR6 P50406 1/20 0.36
CHRNA7 P36544 2/20 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
SCHEMBL4643306 0.84 PTPN1 (0.53) PTPN1PTPN2PTGER1CYP1A2
SCHEMBL12056127 0.84 PTPN1 (0.50) PTPN1MAPK14PTPN2PTGER1HTR6
SCHEMBL3005189 0.82 PTPN1 (0.48) PTPN1MAPK14BRD4PTPN2SNRNP200
SCHEMBL3006427 0.82 PTPN1 (0.46) PTPN1PTPN2PTGER1CYP1A2SNRNP200
SCHEMBL629845 0.82 PTPN1 (0.46) PTPN1PTPN2PTGER1CYP1A2SNRNP200
SCHEMBL646553 0.82 PTPN1 (0.43) PTPN1MAPK14BRD4PTPN2PTGER1
SCHEMBL3006552 0.81 PTPN1 (0.44) PTPN1MAPK14PTPN2PTGER1CYP1A2
SCHEMBL630221 0.81 PTPN1 (0.49) PTPN1BRD4SNRNP200CHRNA7
SCHEMBL31285248 0.80 PTPN2 (0.41) PTPN1MAPK14BRD4PTPN2
SCHEMBL3917446 0.80 PTPN1 (0.47) PTPN1MAPK14PTPN2SNRNP200CHRNA7

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 10/4885MAPK14 1620/4885BRD4 3536/4885

“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.