SCHEMBL6583618

SCHEMBL6583618

CCCCC(=O)c1c(-c2ccc3cc(OCC#N)ccc3c2)oc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
CNR1 P21554 2/20 0.42
CNR2 P34972 2/20 0.42
BCHE P06276 2/20 0.42
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
MAPK1 P28482 1/20 0.41
RECQL P46063 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 4/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
ATM Q13315 1/20 0.41
ANO1 Q5XXA6 9/20 0.41
APP P05067 1/20 0.41

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
SCHEMBL6583854 0.88 SLC2A1 (0.49) KDM4EALDH1A1HPGDMAPK1RECQL
SCHEMBL6579600 0.87 LMNA (0.42) LMNAHTTCNR1CNR2BCHE
SCHEMBL6579471 0.87 LMNA (0.53) LMNAHTTKDM4EALDH1A1HPGD
SCHEMBL6582215 0.86 CNR2 (0.56) LMNAHTTCNR1CNR2BCHE
SCHEMBL6579841 0.86 LMNA (0.40) LMNAHTTCNR1CNR2BCHE
SCHEMBL6581594 0.86 PTPN1 (0.47) LMNAHTTCNR1CNR2BCHE
SCHEMBL6579760 0.85 LMNA (0.39) LMNAHTTCNR1CNR2BCHE
SCHEMBL6582307 0.84 KDM4E (0.52) LMNAHTTCNR1CNR2BCHE
SCHEMBL6581446 0.82 LMNA (0.53) LMNAHTTCNR1CNR2BCHE
SCHEMBL6580328 0.82 ANO1 (0.41) LMNAHTTCNR1CNR2BCHE

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 549/4885CNR1 109/4885

“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.