SCHEMBL9379151

SCHEMBL9379151

[C]1=CC(Cc2ccccc2)C1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.41
POLB P06746 1/20 0.37
CCR3 P51677 1/20 0.37
CALM1 P0DP23 1/20 0.36

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
SCHEMBL7565494 0.73 GBA1 (0.45) GBA1POLBCCR3CALM1
SCHEMBL6519938 0.71 GBA1 (0.43) GBA1POLBCCR3CALM1
SCHEMBL1930265 0.70 GBA1 (0.47) GBA1POLBCCR3
SCHEMBL1200483 0.70 GBA1 (0.42) GBA1POLBCCR3CALM1
SCHEMBL9700293 0.67 ALDH1A1 (0.37) GBA1CALM1
SCHEMBL2027845 0.65 GBA1 (0.71) GBA1CCR3
SCHEMBL19809006 0.65 CALM1 (0.43) GBA1CALM1
SCHEMBL674276 0.65 GBA1 (0.71) GBA1CCR3
SCHEMBL1200566 0.65 GBA1 (0.42) GBA1POLBCCR3
SCHEMBL1929149 0.65 POLB (0.43) GBA1POLBCCR3

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-0428437-B1 1,2-Benzisoxazole derivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1994-08-17 EP disclosed
EP-0428437-A1 1,2-Benzisoxazole derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1991-05-22 EP disclosed