SCHEMBL5145019

SCHEMBL5145019

Cc1cc(-c2ccc(/C=C3/SC(=S)N(CC(=O)O)C3=O)o2)ccc1[N+](=O)[O-]

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTPN22 Q9Y2R2 2/20 0.65
▸ APEX1 P27695 1/20 0.64
▸ MAPT P10636 1/20 0.64
▸ MAP3K5 Q99683 4/20 0.62
▸ STAT3 P40763 1/20 0.55
▸ HIF1AN Q9NWT6 1/20 0.54

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
SCHEMBL3896088 1.00 PTPN22 (0.65) PTPN22APEX1MAPTMAP3K5STAT3
SCHEMBL3896084 1.00 PTPN22 (0.65) PTPN22APEX1MAPTMAP3K5STAT3
SCHEMBL5164951 0.93 PTPN22 (0.65) PTPN22APEX1MAPTMAP3K5STAT3
SCHEMBL5164957 0.93 PTPN22 (0.65) PTPN22APEX1MAPTMAP3K5STAT3
SCHEMBL3897122 0.88 MAPT (0.69) PTPN22APEX1MAPTMAP3K5
SCHEMBL3897115 0.88 MAPT (0.69) PTPN22APEX1MAPTMAP3K5
SCHEMBL3892183 0.87 MEN1 (0.65) PTPN22APEX1MAPTMAP3K5STAT3
SCHEMBL3892188 0.87 MEN1 (0.65) PTPN22APEX1MAPTMAP3K5STAT3
SCHEMBL16492655 0.85 MAPT (0.70) PTPN22APEX1MAPTMAP3K5STAT3
SCHEMBL3904803 0.85 MAP3K5 (0.82) PTPN22APEX1MAPTMAP3K5STAT3

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
EP-1718308-A4 METHODS OF MODULATING NEUROTROPHIN-MEDIATED ACTIVITY PAINCEPTOR PHARMA CORP (CA) 2007-07-18 — — EP disclosed
EP-1718308-A2 METHODS OF MODULATING NEUROTROPHIN-MEDIATED ACTIVITY PainCeptor Pharma Corp. (CA) 2006-11-08 — — EP disclosed
US-20050282840-A1 Methods of modulating neurotrophin-mediated activity PAINCEPTOR PHARMA CORPORATION (CA) 2005-12-22 — — US disclosed
WO-2005076695-A2 METHODS OF MODULATING NEUROTROPHIN-MEDIATED ACTIVITY PAINCEPTOR PHARMA CORPORATION (CA) 2005-08-25 — — 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-20050282840-A1 Methods of modulating neurotrophin-mediated activity NGF, BDNF, NTRK2 PTPN22 1167/4885APEX1 2696/4885MAPT 2096/4885

“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.

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