SCHEMBL30801667

SCHEMBL30801667

CC(C)(C)OC(=O)N1CCCC2(C1)CN([C@@H](CO)C(=O)O)C2=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.43
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
HRH3 Q9Y5N1 1/20 0.35
MMP2 P08253 1/20 0.35
MMP13 P45452 1/20 0.35
MMP14 P50281 1/20 0.35
ADAM17 P78536 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
SCD5 Q86SK9 1/20 0.34
TSHR P16473 2/20 0.34
ALOX15 P16050 1/20 0.34
ATM Q13315 1/20 0.34
HPGD P15428 1/20 0.33
PIK3R1 P27986 1/20 0.33
PIK3CA P42336 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL30801658 0.90 GRIN2B (0.44) USP30GRIN2BGRIN2CHRH3MMP2
SCHEMBL30801691 0.82 GRIN2B (0.53) USP30GRIN2BGRIN2CHRH3MMP2
SCHEMBL15936912 0.79 GRIN2B (0.62) USP30GRIN2BGRIN2CKDM4EMAPT
SCHEMBL3497329 0.78 USP30 (0.47) USP30GRIN2BGRIN2CHRH3MMP2
SCHEMBL30801725 0.77 USP30 (0.42) USP30GRIN2BGRIN2CTSHRALOX15
SCHEMBL27329709 0.77 GRIN2B (0.44) USP30GRIN2BGRIN2CHRH3KDM4E
SCHEMBL30801705 0.77 USP30 (0.42) USP30MAPTMEN1KMT2A
SCHEMBL30801734 0.77 GRIN2B (0.66) USP30GRIN2BGRIN2CHRH3MMP2
SCHEMBL30801707 0.76 USP30 (0.45) USP30HRH3KDM4EMAPTTHRB
SCHEMBL27330081 0.76 USP30 (0.48) USP30GRIN2BGRIN2CHRH3KDM4E

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-2024054919-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (CN) 2024-03-14 WO disclosed