SCHEMBL6579770

SCHEMBL6579770

N#CCOc1ccc2cc(-c3oc4ccccc4c3C(=O)c3ccccc3)ccc2c1Br

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
PTPN1 P18031 3/20 0.42
BCHE P06276 8/20 0.41
ACHE P22303 3/20 0.41
CNR1 P21554 4/20 0.41
ANO1 Q5XXA6 2/20 0.41
CNR2 P34972 5/20 0.39
TNKS O95271 1/20 0.39
APP P05067 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.38
ALOX15 P16050 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL6579423 0.86 PTPN1 (0.40) L3MBTL1PTPN1BCHEACHEANO1
SCHEMBL6581594 0.85 PTPN1 (0.47) PTPN1BCHEACHECNR1ANO1
SCHEMBL6582393 0.84 TP53 (0.41) L3MBTL1PTPN1CNR1ANO1CNR2
SCHEMBL6585048 0.82 PTPN1 (0.42) L3MBTL1PTPN1BCHEACHECNR1
SCHEMBL6581737 0.80 L3MBTL1 (0.48) L3MBTL1PTPN1BCHEACHECNR1
SCHEMBL6584870 0.80 L3MBTL1 (0.48) L3MBTL1PTPN1BCHEACHECNR1
SCHEMBL6579756 0.77 PTPN1 (0.49) PTPN1MAPTSMN1; SMN2
SCHEMBL6579760 0.76 LMNA (0.39) L3MBTL1PTPN1BCHEACHECNR1
SCHEMBL6581762 0.75 PTPN1 (0.51) L3MBTL1PTPN1ANO1CASP1CASP7
SCHEMBL6579600 0.75 LMNA (0.42) L3MBTL1PTPN1BCHEACHECNR1

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 L3MBTL1 2248/4885PTPN1 1287/4885BCHE 2003/4885

“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.