SCHEMBL1908885

SCHEMBL1908885

N#Cc1c(Cc2ccc(N3CC(=O)NS3(=O)=O)c(O)c2)cccc1C(F)(F)F

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 9/20 0.54
P2RX7 Q99572 2/20 0.38
TNKS O95271 7/20 0.34
TNKS2 Q9H2K2 7/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
TRPC5 Q9UL62 1/20 0.33
PTPN2 P17706 3/20 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
SCHEMBL648958 0.89 PTPN1 (0.59) PTPN1PTPN2
SCHEMBL646151 0.87 PTPN1 (0.60) PTPN1PTPN2
SCHEMBL647149 0.87 PTPN1 (0.57) PTPN1P2RX7PTPN2
SCHEMBL647910 0.82 PTPN1 (0.58) PTPN1PTPN2
SCHEMBL646524 0.81 PTPN1 (0.49) PTPN1PTPN2
SCHEMBL649046 0.80 PTPN1 (0.43) PTPN1P2RX7PTPN2
SCHEMBL2933467 0.80 PTPN1 (0.58) PTPN1PTPN2
SCHEMBL3226681 0.79 PTPN1 (0.63) PTPN1PTPN2
SCHEMBL647598 0.78 PTPN1 (0.60) PTPN1PTPN2
SCHEMBL649557 0.77 PTPN1 (0.64) PTPN1PTPN2

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-8119666-B2 1,2,5-thiazolidine derivatives useful for treating conditions mediated by protein tyrosine phosphatases (PTPase) NOVARTIS AG (CH) 2012-02-21 US disclosed
US-8119666-B2 1,2,5-thiazolidine derivatives useful for treating conditions mediated by protein tyrosine phosphatases (PTPase) NOVARTIS AG (CH) 2012-02-21 US disclosed
US-20080293776-A1 1,2,5-Thiazolidine Derivatives Useful for Treating Conditions Mediated by Protein Tyrosine Phosphatases (Ptpase) NOVARTIS AG (CH) 2008-11-27 US disclosed
US-20080293776-A1 1,2,5-Thiazolidine Derivatives Useful for Treating Conditions Mediated by Protein Tyrosine Phosphatases (Ptpase) 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 (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-20080293776-A1 1,2,5-Thiazolidine Derivatives Useful for Treating Conditions Mediated by Protein Tyrosine Phosphatases (Ptpase) PTPRS, PTPN5, PTPRR PTPN1 17/4885P2RX7 2025/4885TNKS 1601/4885

“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.