SCHEMBL6585552

SCHEMBL6585552

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

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.42
PTPN1 P18031 5/20 0.38
ANO1 Q5XXA6 6/20 0.37
ALOX5 P09917 3/20 0.37
KCNH2 Q12809 1/20 0.36
MAPT P10636 2/20 0.35
TP53 P04637 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
TSHR P16473 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL6581594 0.89 PTPN1 (0.47) PTPN1ANO1MAPTTP53RXFP1
SCHEMBL6582262 0.89 PTPN1 (0.48) SLC2A1PTPN1ANO1ALOX5MAPT
SCHEMBL6583854 0.87 SLC2A1 (0.49) SLC2A1ANO1ALOX5KCNH2MAPT
SCHEMBL6586154 0.86 ALOX5 (0.42) SLC2A1PTPN1ANO1ALOX5MAPT
SCHEMBL6580545 0.84 SLC2A1 (0.37) SLC2A1PTPN1ANO1ALOX5MAPT
SCHEMBL6579758 0.84 ALOX5 (0.42) SLC2A1PTPN1ANO1ALOX5MAPT
SCHEMBL6579841 0.83 LMNA (0.40) SLC2A1PTPN1ANO1MAPTTP53
SCHEMBL6579600 0.80 LMNA (0.42) PTPN1ANO1KCNH2MAPTTP53
SCHEMBL6579760 0.79 LMNA (0.39) PTPN1ANO1MAPTTP53RXFP1
SCHEMBL6581487 0.77 PTPN1 (0.58) PTPN1ANO1RXFP1

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 SLC2A1 2299/4885PTPN1 1287/4885ANO1 3199/4885

“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.