SCHEMBL30732913

SCHEMBL30732913

N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 15/20 0.51
GRN P28799 1/20 0.50
SORT1 Q99523 1/20 0.50
LTA4H P09960 1/20 0.48
MME P08473 1/20 0.44
ACE P12821 1/20 0.44
CPA1 P15085 1/20 0.44
ACE2 Q9BYF1 1/20 0.44
FNTA P49354 1/20 0.44
FNTB P49356 1/20 0.44
PGGT1B P53609 1/20 0.44
CTSS P25774 1/20 0.43
CTSK P43235 1/20 0.43

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
SCHEMBL30541625 1.00 CPB2 (0.51) CPB2GRNSORT1LTA4HMME
SCHEMBL29387045 0.97 GRN (0.52) CPB2GRNSORT1LTA4HMME
SCHEMBL30799462 0.88 GRN (0.50) CPB2GRNSORT1LTA4HMME
SCHEMBL29476605 0.86 FNTA (0.51) CPB2GRNSORT1LTA4HMME
SCHEMBL9146938 0.86 LTA4H (0.50) CPB2GRNSORT1LTA4HMME
SCHEMBL9146946 0.86 LTA4H (0.50) CPB2GRNSORT1LTA4HMME
SCHEMBL30799798 0.85 LTA4H (0.49) CPB2GRNSORT1LTA4HMME
SCHEMBL30799559 0.85 CPB2 (0.48) CPB2GRNSORT1LTA4HMME
SCHEMBL7751628 0.84 CPB2 (0.51) CPB2GRNSORT1LTA4HMME
SCHEMBL3165087 0.83 CPB2 (0.50) CPB2GRNSORT1LTA4HFNTA

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-117472197-A Chinese character phonetic alphabet appointed code input method 王海青 2024-01-30 CN disclosed