SCHEMBL6581929

SCHEMBL6581929

COc1ccc2cc(-c3cc4cc(Cl)ccc4o3)ccc2c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 4/20 0.63
MAOB P27338 5/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
GABRP O00591 1/20 0.54
GABRD O14764 1/20 0.54
GABRA1 P14867 1/20 0.54
GABRB1 P18505 1/20 0.54
GABRG2 P18507 1/20 0.54
KCNA5 P22460 1/20 0.54
GABRB3 P28472 1/20 0.54
GABRA5 P31644 1/20 0.54
GABRA3 P34903 1/20 0.54
GABRA2 P47869 1/20 0.54
GABRB2 P47870 1/20 0.54
GABRA4 P48169 1/20 0.54
GABRE P78334 1/20 0.54
KCNH2 Q12809 1/20 0.54
GABRA6 Q16445 1/20 0.54
GABRG1 Q8N1C3 1/20 0.54

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
SCHEMBL3923822 0.90 MAOB (0.66) APPMAOBCA1CA2GABRP
SCHEMBL14833013 0.83 APP (0.82) APPMAOBKCNA5KCNH2CYP2A6
SCHEMBL29873198 0.83 APP (0.82) APPMAOBKCNA5KCNH2CYP2A6
SCHEMBL6579774 0.81 APP (0.60) APPMAOBKCNA5KCNH2CYP2A6
SCHEMBL11733704 0.81 KCNA5 (0.62) APPMAOBCA1CA2GABRP
SCHEMBL11844763 0.79 APP (0.75) APPMAOBKCNA5KCNH2NPC1
SCHEMBL19683686 0.79 NPC1 (0.47) MAOBCA1CA2GABRPGABRD
SCHEMBL729457 0.78 APP (0.73) APPMAOBNPC1RAB9AMEN1
SCHEMBL735788 0.78 APP (0.73) APPMAOBNPC1RAB9AMEN1
SCHEMBL10047396 0.78 APP (0.73) APPMAOBCA2CYP2A6NPC1

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 APP 3778/4885MAOB 1411/4885CA1 4376/4885

“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.