SCHEMBL8220549

SCHEMBL8220549

CC(C)(C)OC(=O)N1CCCC[C@H]1Cc1cccc(Br)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 1/20 0.47
▸ NR1H2 P55055 2/20 0.46
▸ NR1H3 Q13133 2/20 0.46
▸ KDM1A O60341 1/20 0.44
▸ DAGLA Q9Y4D2 4/20 0.44
▸ UCHL1 P09936 1/20 0.44
▸ FPR3 P25089 1/20 0.42
▸ FPR2 P25090 1/20 0.42
▸ HCRTR1 O43613 2/20 0.42
▸ HCRTR2 O43614 2/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ MAPT P10636 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ ABHD6 Q9BV23 3/20 0.42
▸ PRMT5 O14744 1/20 0.41
▸ DPP4 P27487 1/20 0.41
▸ PDE8B O95263 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40

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
SCHEMBL20828162 0.87 GPR119 (0.48) NR1H2NR1H3KDM1ADAGLAHCRTR1
SCHEMBL14939652 0.87 NR1H2 (0.46) NR1H2NR1H3KDM1ADAGLAHCRTR1
SCHEMBL14939654 0.87 NR1H2 (0.46) NR1H2NR1H3KDM1ADAGLAHCRTR1
SCHEMBL10132498 0.84 NR1H2 (0.48) NR1H2NR1H3KDM1ADAGLAUCHL1
SCHEMBL14940097 0.83 NR1H2 (0.47) USP30NR1H2NR1H3KDM1ADAGLA
SCHEMBL10132370 0.83 ALDH1A1 (0.50) USP30NR1H2NR1H3UCHL1HCRTR1
SCHEMBL10132273 0.83 GPR119 (0.49) NR1H2NR1H3DAGLAUCHL1HCRTR1
SCHEMBL14940096 0.83 NR1H2 (0.47) USP30NR1H2NR1H3KDM1ADAGLA
SCHEMBL17056240 0.83 USP30 (0.49) USP30NR1H2NR1H3KDM1AUCHL1
SCHEMBL1992473 0.82 FPR3 (0.52) USP30NR1H2NR1H3KDM1AUCHL1

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-2008018639-A2 GLYCINE TRANSPORTER INHIBITOR TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-02-14 — — WO disclosed
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