SCHEMBL6579758

SCHEMBL6579758

CCCCC(=O)c1c(-c2ccc3c(Br)c(O)ccc3c2)oc2ccc(Cl)cc12

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.42
SLC2A1 P11166 1/20 0.41
PTPN1 P18031 2/20 0.40
ANO1 Q5XXA6 3/20 0.38
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
ALOX15 P16050 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL6580387 0.87 PTPN1 (0.51) PTPN1ESR1ESR2LMNAHTT
SCHEMBL6581560 0.85 ALOX5 (0.53) ALOX5SLC2A1ANO1LMNAHTT
SCHEMBL6582262 0.85 PTPN1 (0.48) ALOX5SLC2A1PTPN1ANO1TSHR
SCHEMBL6585552 0.84 SLC2A1 (0.42) ALOX5SLC2A1PTPN1ANO1TSHR
SCHEMBL6586154 0.83 ALOX5 (0.42) ALOX5SLC2A1PTPN1ANO1TSHR
SCHEMBL6581754 0.82 SLC2A1 (0.49) ALOX5SLC2A1ANO1LMNAHTT
SCHEMBL6580545 0.79 SLC2A1 (0.37) ALOX5SLC2A1PTPN1ANO1ALOX15
SCHEMBL6579592 0.79 KDM4E (0.50) SLC2A1ANO1LMNA
SCHEMBL6583854 0.77 SLC2A1 (0.49) ALOX5SLC2A1ANO1TSHRMAPT
SCHEMBL6581878 0.76 SLC2A1 (0.47) ALOX5SLC2A1ANO1LMNATSHR

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-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 ALOX5 238/4885SLC2A1 2299/4885PTPN1 1287/4885

“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.