SCHEMBL11736445

SCHEMBL11736445

CCN(CC)CCOc1ccc(-c2oc3ccccc3c2C(=O)c2cc(OC)cc(OC)c2)cc1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.69
▸ BCHE P06276 13/20 0.65
▸ CNR2 P34972 7/20 0.65
▸ CNR1 P21554 7/20 0.65
▸ ACHE P22303 5/20 0.65
▸ L3MBTL1 Q9Y468 2/20 0.60
▸ ATM Q13315 1/20 0.52

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
SCHEMBL11672632 0.92 APP (0.77) APPBCHECNR2CNR1ACHE
SCHEMBL11727691 0.90 APP (0.66) APPBCHECNR2CNR1ACHE
SCHEMBL11734542 0.90 APP (0.68) APPBCHECNR2CNR1ACHE
SCHEMBL11731490 0.89 APP (0.76) APPBCHECNR2CNR1ACHE
SCHEMBL11734682 0.89 APP (0.78) APPBCHECNR2CNR1ACHE
SCHEMBL11726989 0.89 APP (0.69) APPBCHECNR2CNR1ACHE
SCHEMBL11729870 0.89 APP (0.72) APPBCHECNR2CNR1ACHE
SCHEMBL11736401 0.89 APP (0.69) APPBCHECNR2CNR1ACHE
SCHEMBL11733557 0.88 L3MBTL1 (0.65) APPBCHECNR2CNR1ACHE
SCHEMBL11730748 0.87 APP (0.85) APPBCHECNR2CNR1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4001426-A HAVING CORONARY VASODILATOR ACTIVITY SMITHKLINE CORPORATION (US) 1977-01-04 — — US disclosed
Send feedback