SCHEMBL6582638

SCHEMBL6582638

CCCCC(=O)c1c(-c2ccc3cc(OC(Cc4ccccc4)C(=O)OCC)ccc3c2)oc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 10/20 0.49
L3MBTL1 Q9Y468 2/20 0.44
NPC1 O15118 1/20 0.44
ATM Q13315 1/20 0.44
BCHE P06276 4/20 0.42
PTPRF P10586 1/20 0.42
PTPRA P18433 1/20 0.42
PTPN7 P35236 1/20 0.42
DUSP3 P51452 1/20 0.42
PPARA Q07869 2/20 0.41
ACHE P22303 3/20 0.41
KDM4E B2RXH2 3/20 0.41
PPARG P37231 1/20 0.41
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
CNR1 P21554 1/20 0.40

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
SCHEMBL6581832 0.92 PTPN1 (0.57) PTPN1PTPRFPTPRAPTPN7DUSP3
SCHEMBL6579715 0.90 PTPN1 (0.50) PTPN1L3MBTL1NPC1ATMBCHE
SCHEMBL6584826 0.89 PTPN1 (0.59) PTPN1L3MBTL1NPC1ATMBCHE
SCHEMBL6582637 0.83 PTPN1 (0.57) PTPN1PTPRFPTPRAPTPN7DUSP3
SCHEMBL6582215 0.82 CNR2 (0.56) L3MBTL1NPC1ATMBCHEKDM4E
SCHEMBL6582307 0.81 KDM4E (0.52) PTPN1L3MBTL1ATMBCHEPPARA
SCHEMBL6579618 0.81 PTPN1 (0.68) PTPN1PTPRFPTPRAPTPN7DUSP3
SCHEMBL6579471 0.80 LMNA (0.53) PTPN1ATMPTPN7KDM4EALDH1A1
SCHEMBL6581446 0.78 LMNA (0.53) PTPN1L3MBTL1NPC1ATMBCHE
SCHEMBL6583618 0.77 LMNA (0.43) L3MBTL1ATMBCHEKDM4EALDH1A1

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 PTPN1 1287/4885L3MBTL1 2248/4885NPC1 487/4885

“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.