SCHEMBL4316679

SCHEMBL4316679

Cc1ccccc1CCc1ccc(N2CC(=O)NS2(=O)=O)c(O)c1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 11/20 0.57
DAO P14920 3/20 0.48
PTPN2 P17706 6/20 0.39
NR1H3 Q13133 2/20 0.39
GPR84 Q9NQS5 1/20 0.39
NR1H2 P55055 1/20 0.37
NR3C2 P08235 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
SCHEMBL649557 0.91 PTPN1 (0.64) PTPN1DAOPTPN2
SCHEMBL3216277 0.88 PTPN1 (0.49) PTPN1DAOPTPN2
SCHEMBL3223283 0.88 PTPN1 (0.49) PTPN1DAOPTPN2
SCHEMBL3221771 0.87 PTPN1 (0.52) PTPN1DAOPTPN2NR1H3NR1H2
SCHEMBL3215930 0.86 PTPN1 (0.56) PTPN1DAOPTPN2NR1H3NR1H2
SCHEMBL3214274 0.85 PTPN1 (0.52) PTPN1DAOPTPN2GPR84
SCHEMBL3214264 0.85 PTPN1 (0.53) PTPN1DAOPTPN2NR1H3NR1H2
SCHEMBL3216871 0.84 PTPN1 (0.50) PTPN1PTPN2NR1H3NR1H2
SCHEMBL3226681 0.84 PTPN1 (0.63) PTPN1PTPN2
SCHEMBL3213356 0.83 PTPN1 (0.58) PTPN1DAOPTPN2NR1H3GPR84

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090181928-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-07-16 US claimed

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-20090181928-A1 ORGANIC COMPOUNDS PTPRS, PTPRO, PTPRC PTPN1 21/4885DAO 2562/4885PTPN2 5/4885

“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.