SCHEMBL9256916

SCHEMBL9256916

CC(C)(C)c1ccc2nc3c(c(N)c2c1)CCCC3

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACHE P22303 20/20 0.75
BCHE P06276 16/20 0.75
GRIN1 Q05586 11/20 0.66
GRIN2A Q12879 11/20 0.66
CHRM1 P11229 1/20 0.63

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
SCHEMBL9257159 0.89 ACHE (0.68) ACHEBCHEGRIN1GRIN2ACHRM1
SCHEMBL29817802 0.86 BCHE (1.00) ACHEBCHE
SCHEMBL9252701 0.86 MAPT (0.63) ACHEBCHEGRIN1GRIN2ACHRM1
SCHEMBL9260660 0.83 ACHE (0.54) ACHEBCHEGRIN1GRIN2ACHRM1
SCHEMBL5990879 0.80 ACHE (1.00) ACHEBCHEGRIN1GRIN2A
Hydrochloric Acid SCHEMBL29817805 0.79 ACHE (1.00) ACHEBCHEGRIN1GRIN2A
SCHEMBL17992251 0.79 ACHE (0.68) ACHEBCHEGRIN1GRIN2A
Hydrochloric Acid SCHEMBL29817798 0.78 ACHE (1.00) ACHEBCHEGRIN1GRIN2A
SCHEMBL9258833 0.78 ACHE (0.69) ACHEBCHEGRIN1GRIN2ACHRM1
SCHEMBL8018131 0.78 ACHE (1.00) ACHEBCHEGRIN1GRIN2A

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-5391553-A Increasing cholinergic functionin mammals HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-02-21 US disclosed
EP-0282959-A2 Substituted 9-amino-tetrahydro-acridines and related compounds, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1988-09-21 EP disclosed