SCHEMBL6579715

SCHEMBL6579715

CCCCC(=O)c1c(-c2ccc3c(C)c(OC(Cc4ccccc4)C(=O)OCC)ccc3c2)oc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 10/20 0.50
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
NPC1 O15118 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
BCHE P06276 5/20 0.37
ACHE P22303 3/20 0.37
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 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
SCHEMBL6582637 0.94 PTPN1 (0.57) PTPN1LMNAHTTPPARGPPARA
SCHEMBL6584826 0.93 PTPN1 (0.59) PTPN1LMNAHTTNPC1ATM
SCHEMBL6582638 0.90 PTPN1 (0.49) PTPN1NPC1ATML3MBTL1BCHE
SCHEMBL6579618 0.86 PTPN1 (0.68) PTPN1PPARGPPARA
SCHEMBL6583890 0.82 PTPN1 (0.47) PTPN1LMNAHTTNPC1BCHE
SCHEMBL6581832 0.82 PTPN1 (0.57) PTPN1PPARGPPARA
SCHEMBL6582877 0.79 PPARG (0.41) PTPN1NPC1PPARGPPARAMEN1
SCHEMBL6579600 0.79 LMNA (0.42) PTPN1LMNAHTTNPC1ATM
SCHEMBL6581883 0.78 LMNA (0.39) PTPN1LMNAHTTNPC1L3MBTL1
SCHEMBL6582342 0.77 KDM4E (0.43) PTPN1LMNAHTTATML3MBTL1

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 1287/4885LMNA 903/4885HTT 549/4885

“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.