SCHEMBL30988895

SCHEMBL30988895

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)[C@@H](C)O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RAMP3 O60896 13/20 0.53
▸ CALCR P30988 13/20 0.53
▸ MAPK8 P45983 1/20 0.51
▸ MAPK9 P45984 1/20 0.51
▸ MAPK10 P53779 1/20 0.51
▸ EP300 Q09472 1/20 0.50
▸ HIF1A Q16665 1/20 0.50
▸ KEAP1 Q14145 1/20 0.49
▸ NPY2R P49146 3/20 0.49
▸ NPY4R P50391 3/20 0.49
▸ NPY5R Q15761 3/20 0.49
▸ NPY1R P25929 2/20 0.49

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
SCHEMBL30883212 0.97 RAMP3 (0.54) RAMP3CALCREP300HIF1AKEAP1
SCHEMBL30423163 0.87 RAMP3 (0.60) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30607335 0.87 RAMP3 (0.59) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL29679504 0.86 RAMP3 (0.57) RAMP3CALCRMAPK8MAPK9MAPK10
SCHEMBL30386068 0.86 RAMP3 (0.56) RAMP3CALCRMAPK8MAPK9MAPK10
SCHEMBL30175378 0.86 RAMP3 (0.56) RAMP3CALCRMAPK8MAPK9MAPK10
SCHEMBL29680011 0.86 RAMP3 (0.56) RAMP3CALCRMAPK8MAPK9MAPK10
SCHEMBL31416061 0.86 RAMP3 (0.51) RAMP3CALCRMAPK8MAPK9MAPK10
SCHEMBL30900795 0.86 NPY2R (0.57) RAMP3CALCRMAPK8MAPK9MAPK10
SCHEMBL30883225 0.85 NMUR2 (0.54) RAMP3CALCRNPY2RNPY4RNPY5R

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-2024097353-A1 RECOMBINANT ALGAE HAVING HIGH BIOMASS AND LIPID PRODUCTIVITY VIRIDOS, INC. (US) 2024-05-10 — — WO disclosed
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