SCHEMBL9538273

SCHEMBL9538273

CN1c2c(Br)cc(OC(=O)c3ccccc3O)cc2C2(C)CCN(CCc3ccccc3)C12

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BCHE P06276 5/20 0.54
ACHE P22303 5/20 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
SCHEMBL9536742 0.91 BCHE (0.43) BCHEACHE
SCHEMBL9537208 0.91 ACHE (0.44) BCHEACHE
SCHEMBL9541181 0.87 BCHE (0.42) BCHEACHE
SCHEMBL9538866 0.86 BCHE (0.41) BCHEACHE
SCHEMBL9538390 0.85 BCHE (0.73) BCHEACHE
Salicylic Acid SCHEMBL9538265 0.85 BCHE (0.48) BCHEACHE
SCHEMBL2459729 0.84 BCHE (0.55) BCHEACHE
SCHEMBL2459728 0.84 BCHE (0.55) BCHEACHE
SCHEMBL9540882 0.84 BCHE (0.55) BCHEACHE
Bromide SCHEMBL9539186 0.83 BCHE (0.54) BCHEACHE

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-5187165-A Eseroline derivatives; cholinergic agents; antidepressants HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1993-02-16 US disclosed