SCHEMBL7918007

SCHEMBL7918007

CC(C)(C)OC(=O)N[C@]1(CO)Cc2cccc(Br)c2C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
GHSR Q92847 1/20 0.37
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
EPHX2 P34913 1/20 0.34
MME P08473 4/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
P2RX7 Q99572 1/20 0.34
PPIA P62937 1/20 0.34
NAMPT P43490 2/20 0.33
UCHL1 P09936 1/20 0.33
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
AKT1 P31749 1/20 0.32
BACE1 P56817 1/20 0.32

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
SCHEMBL7920547 1.00 MEN1 (0.38) MEN1NPC1HTTRAB9AKMT2A
SCHEMBL12203923 0.91 MEN1 (0.36) MEN1NPC1HTTRAB9AKMT2A
SCHEMBL7917374 0.91 GHSR (0.42) MEN1NPC1HTTRAB9AKMT2A
SCHEMBL7922109 0.84 GHSR (0.36) GHSRDPP8DPP9EPHX2MME
SCHEMBL7917735 0.83 GHSR (0.38) MEN1NPC1HTTRAB9AKMT2A
SCHEMBL7916929 0.80 GHSR (0.41) MEN1NPC1HTTRAB9AKMT2A
SCHEMBL7921532 0.80 GHSR (0.41) MEN1NPC1HTTRAB9AKMT2A
SCHEMBL7909436 0.79 RAB9A (0.38) MEN1NPC1HTTRAB9AKMT2A
SCHEMBL15353791 0.79 NPC1 (0.38) MEN1NPC1HTTRAB9AKMT2A
SCHEMBL7918729 0.78 NPC1 (0.37) MEN1NPC1HTTRAB9AKMT2A

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-2010042473-A1 BIARYL SPIROAMINOOXAZOLINE ANALOGUES AS ALPHA2C ADRENERGIC RECEPTOR MODULATORS SCHERING CORPORATION (US) 2010-04-15 WO disclosed