SCHEMBL31580719

SCHEMBL31580719

CC(C)(C)OC(=O)N1CC(N2CCN3c4ccc(Br)cc4OC[C@H]3C2)C1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 6/20 0.42
FPR2 P25090 4/20 0.42
BACE1 P56817 6/20 0.37
RORC P51449 2/20 0.35
SCN9A Q15858 1/20 0.35
FPR3 P25089 1/20 0.34
KCNK3 O14649 1/20 0.34
KCNK9 Q9NPC2 1/20 0.34

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
SCHEMBL31580347 1.00 USP30 (0.42) USP30FPR2BACE1RORCSCN9A
SCHEMBL30834655 0.92 USP30 (0.42) USP30FPR2BACE1RORC
SCHEMBL30834647 0.92 USP30 (0.42) USP30FPR2BACE1RORC
SCHEMBL30834657 0.92 USP30 (0.42) USP30FPR2BACE1RORC
SCHEMBL31582194 0.84 USP30 (0.42) USP30FPR2BACE1RORC
SCHEMBL31580200 0.83 USP30 (0.45) USP30FPR2BACE1SCN9A
SCHEMBL24429872 0.81 USP30 (0.41) USP30BACE1
SCHEMBL4409882 0.80 FPR2 (0.43) USP30FPR2BACE1RORC
SCHEMBL19021651 0.80 NR1H2 (0.45) USP30SCN9A
SCHEMBL31458525 0.80 NR1H2 (0.45) USP30SCN9A

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-2025102600-A1 NOVEL HETEROCYCLIC COMPOUND 首药控股(北京)股份有限公司 2025-05-22 WO disclosed