SCHEMBL30801671

SCHEMBL30801671

C[C@@H](O)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCC2(C1)CN([C@H](C(N)=O)[C@@H](C)O)C2=O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 2/20 0.45
CTSL P07711 6/20 0.44
CTSS P25774 5/20 0.44
CTSK P43235 7/20 0.42
CTSB P07858 3/20 0.42
CAPN1 P07384 3/20 0.40
DPP4 P27487 1/20 0.39
KCNH2 Q12809 1/20 0.39
DPP7 Q9UHL4 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
PSMB8 P28062 1/20 0.39
PSMB9 P28065 1/20 0.39
PSMB5 P28074 1/20 0.39
PREP P48147 2/20 0.38

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
SCHEMBL30801716 0.91 CCR1 (0.51) CCR1CTSLCTSSCTSKCTSB
SCHEMBL30801737 0.82 CCR1 (0.48) CCR1CTSLCTSSCTSKCTSB
SCHEMBL30801747 0.76 GRIN2B (0.48)
SCHEMBL30801693 0.74 GRIN2B (0.47) DPP4DPP7PREP
SCHEMBL19853771 0.74 GRIN2B (0.41) DPP4KCNH2DPP7ALDH1A1
SCHEMBL17281441 0.74 CCR1 (0.50) CCR1CTSLCTSSCTSKCTSB
SCHEMBL30801704 0.73 CCR1 (0.55) CCR1CTSLCTSSCTSKCTSB
SCHEMBL13502399 0.72 CTSL (0.58) CCR1CTSLCTSSCTSKCTSB
SCHEMBL21034523 0.72 OPRM1 (0.42) DPP4
SCHEMBL19853726 0.72 OPRM1 (0.42) DPP4

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