SCHEMBL648879

SCHEMBL648879

Cc1ccc(Cc2ccc(N3CC(=O)NS3(=O)=O)c(OCc3ccccc3)c2)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 6/20 0.42
MRGPRX4 Q96LA9 1/20 0.37
PTPN2 P17706 1/20 0.35
PTGER1 P34995 4/20 0.34
CYP1A2 P05177 1/20 0.34
PTGER4 P35408 1/20 0.33
PTGER3 P43115 1/20 0.33
PTGER2 P43116 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
MAPK14 Q16539 3/20 0.33
S1PR5 Q9H228 1/20 0.33
CTSV O60911 1/20 0.33
CTSL P07711 1/20 0.33
MAOB P27338 1/20 0.33

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
SCHEMBL12056127 0.87 PTPN1 (0.50) PTPN1MRGPRX4PTPN2PTGER1PTGER4
SCHEMBL647607 0.86 PTPN1 (0.42) PTPN1
SCHEMBL646919 0.85 PTPN1 (0.47) PTPN1PTPN2KDM4C
SCHEMBL3917104 0.84 PTPN1 (0.46) PTPN1PTPN2PTGER1CYP1A2KDM4C
SCHEMBL3926349 0.83 PTPN1 (0.45) PTPN1PTPN2PTGER1CYP1A2
SCHEMBL3920465 0.81 PTPN1 (0.45) PTPN1PTGER1CYP1A2PTGER4PTGER3
SCHEMBL3929067 0.81 PTPN1 (0.45) PTPN1PTPN2PTGER1CYP1A2PTGER4
SCHEMBL3005189 0.81 PTPN1 (0.48) PTPN1MRGPRX4PTPN2MAPK14MAOB
SCHEMBL3926449 0.81 PTPN1 (0.43) PTPN1MAOB
SCHEMBL647600 0.81 PTPN1 (0.56) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1963294-B1 1,2,5-THIAZOLIDINE DERIVATIVES USEFUL FOR TREATING CONDITIONS MEDIATED BY PROTEIN TYROSINE PHOSPHATASES (PTPASE) NOVARTIS AG (CH) 2012-10-10 EP 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
EP-1963294-A1 1,2,5-THIAZOLIDINE DERIVATIVES USEFUL FOR TREATING CONDITIONS MEDIATED BY PROTEIN TYROSINE PHOSPHATASES (PTPASE) Novartis AG (CH) 2008-09-03 EP disclosed
WO-2007067613-A1 1,2,5-THIAZOLIDINE DERIVATIVES USEFUL FOR TREATING CONDITIONS MEDIATED BY PROTEIN TYROSINE PHOSPHATASES (PTPASE) 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-20080293776-A1 1,2,5-Thiazolidine Derivatives Useful for Treating Conditions Mediated by Protein Tyrosine Phosphatases (Ptpase) PTPRS, PTPN5, PTPRR PTPN1 17/4885MRGPRX4 1398/4885PTPN2 9/4885

“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.