SCHEMBL9748544

SCHEMBL9748544

CC(C)Nc1c2c(nc3ccccc13)CCCC2

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA2D1 P54289 1/20 0.63
ACHE P22303 8/20 0.63
BCHE P06276 8/20 0.62
APP P05067 2/20 0.62
BACE1 P56817 2/20 0.62
GABRP O00591 1/20 0.62
GABRD O14764 1/20 0.62
GABRA1 P14867 1/20 0.62
GABRB1 P18505 1/20 0.62
GABRG2 P18507 1/20 0.62
GABRB3 P28472 1/20 0.62
GABRA5 P31644 1/20 0.62
GABRA3 P34903 1/20 0.62
GABRA2 P47869 1/20 0.62
GABRB2 P47870 1/20 0.62
GABRA4 P48169 1/20 0.62
GABRE P78334 1/20 0.62
GABRA6 Q16445 1/20 0.62
GABRG1 Q8N1C3 1/20 0.62
GABRG3 Q99928 1/20 0.62

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
SCHEMBL29522722 0.84 ACHE (0.66) ACHEBCHEAPPBACE1GABRP
SCHEMBL16684277 0.84 ACHE (0.66) ACHEBCHEAPPBACE1GABRP
SCHEMBL22930959 0.83 CACNA2D1 (0.62) CACNA2D1ACHEBCHEAPPBACE1
SCHEMBL22930960 0.81 CACNA2D1 (0.54) CACNA2D1ACHEBCHEAPPBACE1
SCHEMBL7945036 0.81 BCHE (0.65) ACHEBCHEAPPBACE1GABRP
SCHEMBL22930961 0.81 BCHE (0.72) ACHEBCHEAPPBACE1GABRP
SCHEMBL12552069 0.81 ACHE (0.73) ACHEBCHEAPPBACE1GABRP
SCHEMBL7941639 0.81 ACHE (0.61) ACHEBCHEAPPBACE1GABRP
SCHEMBL17124047 0.81 ACHE (0.61) ACHEBCHEAPPBACE1GABRP
SCHEMBL14232862 0.80 ACHE (0.66) ACHEBCHE

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-5175172-A Administering amino-1,2,3,4-tetrahydroacridine and derivatives for elevation of T4 lymphocytes level in patients DIETLIN FRANCOIS (FR) 1992-12-29 US disclosed