SCHEMBL11673527

SCHEMBL11673527

CCN(CC)CCCOc1ccc(C(=O)c2c(-c3c(OC)cc(OC)cc3OC)oc3ccccc23)cc1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.68
▸ CNR1 P21554 7/20 0.59
▸ CNR2 P34972 6/20 0.59
▸ BCHE P06276 13/20 0.57
▸ ACHE P22303 6/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ XDH P47989 1/20 0.50
▸ SLC2A1 P11166 1/20 0.50

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
SCHEMBL11730748 0.87 APP (0.85) APPCNR1CNR2BCHEACHE
SCHEMBL11673509 0.87 APP (0.85) APPCNR1CNR2BCHEACHE
SCHEMBL11673109 0.86 APP (0.75) APPCNR1CNR2BCHEACHE
SCHEMBL11672968 0.86 APP (0.73) APPCNR1CNR2BCHEACHE
SCHEMBL11673346 0.85 APP (0.70) APPCNR1CNR2BCHEACHE
SCHEMBL11672542 0.84 APP (0.87) APPCNR1CNR2BCHEACHE
SCHEMBL11672068 0.83 APP (0.76) APPCNR1CNR2BCHEACHE
SCHEMBL11673919 0.82 APP (0.84) APPCNR1CNR2BCHEACHE
SCHEMBL11672992 0.82 APP (0.66) APPCNR1CNR2BCHEACHE
SCHEMBL11672546 0.82 APP (0.87) APPCNR1CNR2BCHEACHE

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4024273-A Coronary vasodilator and anti-anginal compositions comprising substituted benzofurans and benzothiophenes and methods of producing coronary vasodilation and anti-anginal activity SMITHKLINE CORPORATION (US) 1977-05-17 — — US disclosed
US-3947470-A CORONARY VASODILATORS, TREATMENT OF ANGINA PECTORIS SMITHKLINE CORPORATION (US) 1976-03-30 — — US disclosed
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