SCHEMBL6579600

SCHEMBL6579600

CCCCC(=O)c1c(-c2ccc3c(C)c(OCC#N)ccc3c2)oc2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PTPN1 P18031 4/20 0.37
BCHE P06276 3/20 0.36
CNR1 P21554 2/20 0.36
CNR2 P34972 2/20 0.36
APP P05067 1/20 0.36
KCNH2 Q12809 1/20 0.36
TNKS O95271 1/20 0.35
ACHE P22303 1/20 0.35
L3MBTL1 Q9Y468 3/20 0.34
ATM Q13315 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL6579841 0.91 LMNA (0.40) LMNAHTTTP53MAPTRXFP1
SCHEMBL6581594 0.91 PTPN1 (0.47) LMNAHTTTP53MAPTRXFP1
SCHEMBL6579760 0.90 LMNA (0.39) LMNAHTTTP53MAPTRXFP1
SCHEMBL6583890 0.88 PTPN1 (0.47) LMNAHTTTP53MAPTRXFP1
SCHEMBL6583618 0.87 LMNA (0.43) LMNAHTTMAPTBCHECNR1
SCHEMBL6581848 0.86 ANO1 (0.38) LMNAHTTTP53MAPTRXFP1
SCHEMBL6582762 0.83 LMNA (0.38) LMNAHTTTP53MAPTRXFP1
SCHEMBL6582439 0.83 PTPN1 (0.39) TP53MAPTRXFP1PTPN1
SCHEMBL6581742 0.82 TP53 (0.36) LMNATP53MAPTRXFP1PTPN1
SCHEMBL6581883 0.80 LMNA (0.39) LMNAHTTTP53MAPTRXFP1

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 LMNA 903/4885HTT 549/4885TP53 4050/4885

“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.