SCHEMBL25810483

SCHEMBL25810483

CC(C)COC(=O)CN1CCC(n2cc(B3OC(C)(C)C(C)(C)O3)cn2)C1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.36
GPR119 Q8TDV5 1/20 0.33
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
OGA O60502 1/20 0.31
USP30 Q70CQ3 1/20 0.31
KDM5A P29375 2/20 0.31

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
SCHEMBL25810466 0.85 FFAR1 (0.42) FFAR1USP30
SCHEMBL25810563 0.79 FFAR1 (0.43) FFAR1USP30
SCHEMBL25810492 0.78 FFAR1 (0.40) FFAR1USP30
SCHEMBL25253927 0.75 USP30 (0.40) FFAR1USP30
SCHEMBL16342703 0.75 FFAR1 (0.41) FFAR1USP30KDM5A
SCHEMBL23211127 0.75 FFAR1 (0.41) FFAR1USP30KDM5A
SCHEMBL23211118 0.75 FFAR1 (0.41) FFAR1USP30KDM5A
SCHEMBL21626900 0.74 FFAR1 (0.44) FFAR1
SCHEMBL21808282 0.74 FFAR1 (0.40) FFAR1OGAUSP30KDM5A
SCHEMBL25810566 0.74 FFAR1 (0.42) FFAR1USP30

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
WO-2023115150-A1 BIFUNCTIONAL ARYLSULPHONAMIDE COMPOUNDS Anaxis Pharma Pty Ltd (AU) 2023-06-29 WO disclosed