SCHEMBL30440774

SCHEMBL30440774

CC(C)[C@H](NC(=O)CNC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)O)[C@@H](C)O

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 15/20 0.57
▸ PRMT1 Q99873 1/20 0.56
▸ GRPR P30550 2/20 0.53
▸ MAGI3 Q5TCQ9 1/20 0.52

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
SCHEMBL29508322 0.88 GLP1R (0.44) GLP1RGRPR
SCHEMBL30880899 0.88 GLP1R (0.63) GLP1R
SCHEMBL29523517 0.86 PRMT1 (0.66) GLP1RPRMT1MAGI3
SCHEMBL29479876 0.85 GLP1R (0.70) GLP1R
SCHEMBL25869282 0.85 GRPR (0.56) GLP1RGRPR
SCHEMBL30254040 0.85 GRPR (0.51) GLP1RPRMT1GRPR
SCHEMBL30254236 0.85 GRPR (0.51) GLP1RPRMT1GRPR
SCHEMBL29522786 0.83 PRMT1 (0.62) GLP1RPRMT1GRPRMAGI3
SCHEMBL31683321 0.83 PRMT1 (0.62) GLP1RPRMT1GRPRMAGI3
SCHEMBL31073592 0.83 GLP1R (0.56) GLP1RGRPR

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
CN-116249543-A Antiviral and cytokine storm treatment methods 上海威莫思生物科技有限公司 2023-06-09 — — CN disclosed
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