SCHEMBL7811897

SCHEMBL7811897

CS[n+]1cccc2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.42
BCHE P06276 13/20 0.42

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
SCHEMBL9022926 0.77 ACHE (0.42) ACHEBCHE
SCHEMBL9478372 0.72 ACHE (0.38) ACHEBCHE
SCHEMBL9025548 0.69 ACHE (0.41) ACHEBCHE
SCHEMBL29752612 0.69 ACHE (0.53) ACHEBCHE
SCHEMBL307903 0.69 ACHE (0.53) ACHEBCHE
Hydrochloric Acid SCHEMBL2031419 0.67 ACHE (0.52) ACHEBCHE
Iodide SCHEMBL29462685 0.67 ACHE (0.55) ACHEBCHE
Bromide SCHEMBL7776277 0.67 ACHE (0.52) ACHEBCHE
Bromide SCHEMBL5611688 0.67 ACHE (0.52) ACHEBCHE
Iodide SCHEMBL29462677 0.67 ACHE (0.52) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1097138-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING 2-QUINOLONES LABORATOIRE L. LAFON (FR) 2001-05-09 EP disclosed
WO-2000003990-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING 2-QUINOLONES LABORATOIRE L. LAFON (FR) 2000-01-27 WO disclosed