SCHEMBL6581487

SCHEMBL6581487

CCCCC(=O)c1c(-c2ccc3c(Br)c(OCC(=O)O)ccc3c2)oc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 9/20 0.58
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
ALDH1A1 P00352 4/20 0.41
PRNP P04156 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
LMNA P02545 2/20 0.41
HTT P42858 1/20 0.41
KDM4E B2RXH2 4/20 0.41
GAA P10253 1/20 0.39
ANO1 Q5XXA6 2/20 0.39

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
SCHEMBL6579721 0.91 PTPN1 (0.48) PTPN1ALDH1A1PRNPRXFP1LMNA
SCHEMBL6583890 0.90 PTPN1 (0.47) PTPN1THRATHRBALDH1A1RXFP1
SCHEMBL6579740 0.90 PTPN1 (0.46) PTPN1THRATHRBALDH1A1RXFP1
SCHEMBL6580117 0.90 PTPN1 (0.46) PTPN1THRATHRBALDH1A1RXFP1
SCHEMBL6585755 0.90 PTPN1 (0.48) PTPN1THRATHRBALDH1A1RXFP1
SCHEMBL6582262 0.89 PTPN1 (0.48) PTPN1ALDH1A1RXFP1KDM4EANO1
SCHEMBL6581594 0.88 PTPN1 (0.47) PTPN1RXFP1LMNAHTTANO1
SCHEMBL6581762 0.88 PTPN1 (0.51) PTPN1THRATHRBALDH1A1PRNP
SCHEMBL6579471 0.85 LMNA (0.53) PTPN1THRATHRBALDH1A1LMNA
SCHEMBL6582980 0.85 PTPN1 (0.66) PTPN1THRATHRBALDH1A1PRNP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1401822-A1 NAPHTHYL BENZOFURAN DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) Wyeth (US) 2004-03-31 EP claimed
US-6599925-B2 Cardiovascular disorders; anticancer agents WYETH 2003-07-29 US claimed
US-20030018067-A1 Substituted naphthyl benzofuran derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) WYETH 2003-01-23 US claimed
WO-2003000671-A1 NAPHTHYL BENZOFURAN DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) WYETH (US) 2003-01-03 WO claimed
EP-1401822-A1 NAPHTHYL BENZOFURAN DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) Wyeth (US) 2004-03-31 EP disclosed
US-6599925-B2 Cardiovascular disorders; anticancer agents WYETH 2003-07-29 US disclosed
US-20030018067-A1 Substituted naphthyl benzofuran derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) WYETH 2003-01-23 US disclosed
WO-2003000671-A1 NAPHTHYL BENZOFURAN DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) WYETH (US) 2003-01-03 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-20030018067-A1 Substituted naphthyl benzofuran derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) F2R, SERPINE1, SERPINC1 PTPN1 1287/4885THRA 1185/4885THRB 1088/4885

“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.