SCHEMBL31603946

SCHEMBL31603946

CC(C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CN)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(C)C

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 4/20 0.62
▸ CALCR P30988 4/20 0.60
▸ NPY2R P49146 7/20 0.56
▸ NPY4R P50391 7/20 0.56
▸ NPY5R Q15761 7/20 0.56
▸ NPY1R P25929 5/20 0.56
▸ CRHR1 P34998 1/20 0.55
▸ CRHR2 Q13324 1/20 0.55
▸ EPHA2 P29317 1/20 0.54
▸ TFPI P10646 1/20 0.54
▸ NMBR P28336 1/20 0.54
▸ GRPR P30550 1/20 0.54

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
SCHEMBL31603935 0.96 CALCR (0.64) F2CALCRNPY2RNPY4RNPY5R
SCHEMBL31603944 0.89 NMBR (0.62) F2CALCRNPY2RNPY4RNPY5R
SCHEMBL31182732 0.88 CALCR (0.69) F2CALCRNPY2RNPY4RNPY5R
SCHEMBL30432123 0.88 CALCR (0.68) F2CALCRNPY2RNPY4RNPY5R
SCHEMBL31603934 0.87 NMBR (0.63) F2CALCRNPY2RNPY4RNPY5R
SCHEMBL31041741 0.86 CALCR (0.65) F2CALCRCRHR1CRHR2
SCHEMBL30274543 0.85 F2 (0.56) F2CALCRNPY2RNPY4RNPY5R
SCHEMBL30906471 0.85 CALCR (0.66) F2CALCRCRHR1CRHR2NMBR
SCHEMBL30495663 0.85 F2 (0.71) F2CALCRNPY2RNPY4RNPY5R
SCHEMBL31041761 0.85 CALCR (0.62) F2CALCRCRHR1CRHR2NMBR

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-120058871-A Salty peptides, compositions and uses thereof 陕西科技大学 2025-05-30 — — CN disclosed
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