SCHEMBL29728671

SCHEMBL29728671

CC[C@@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C(CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CNC(=O)C(CCCCN)NC(=O)C(CC(C)C)NC(=O)[C@H](NC(=O)C(CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)C(CC(C)C)NC(=O)CN)C(C)O)C(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](CS)C(=O)N[C@H](CCCCN)C(=O)N[C@H](CC(C)C)C(=O)N1CCCC1C(=O)O)[C@@H](C)O

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CALCR P30988 5/20 0.60
▸ KEAP1 Q14145 4/20 0.56
▸ MAPK8 P45983 1/20 0.55
▸ MAPK9 P45984 1/20 0.55
▸ MAPK10 P53779 1/20 0.55
▸ HCRTR1 O43613 1/20 0.55
▸ HCRTR2 O43614 1/20 0.55
▸ CCKBR P32239 2/20 0.52
▸ GLP1R P43220 2/20 0.52
▸ OPRM1 P35372 2/20 0.51
▸ OPRD1 P41143 2/20 0.51
▸ OPRK1 P41145 2/20 0.51
▸ CRHR1 P34998 1/20 0.51
▸ CRHR2 Q13324 1/20 0.51

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
SCHEMBL29728673 1.00 CALCR (0.60) CALCRKEAP1MAPK8MAPK9MAPK10
SCHEMBL30607467 0.87 CALCR (0.64) CALCRMAPK8MAPK9MAPK10HCRTR1
SCHEMBL30432350 0.87 CALCR (0.60) CALCRCRHR1CRHR2
SCHEMBL31182798 0.87 CALCR (0.64) CALCRMAPK8MAPK9MAPK10HCRTR1
SCHEMBL29867735 0.86 CALCR (0.49) CALCRKEAP1HCRTR1HCRTR2
SCHEMBL30437207 0.86 CALCR (0.61) CALCRKEAP1MAPK8MAPK9MAPK10
SCHEMBL29868039 0.86 CALCR (0.70) CALCRHCRTR1HCRTR2CCKBRGLP1R
SCHEMBL30906419 0.86 CALCR (0.65) CALCRKEAP1HCRTR1HCRTR2OPRM1
SCHEMBL31182878 0.85 CALCR (0.70) CALCRHCRTR1HCRTR2OPRM1OPRD1
SCHEMBL30658198 0.85 CALCR (0.70) CALCRHCRTR1HCRTR2CCKBRGLP1R

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250332215-A1 ANTIMICROBIAL PEPTIDES PROVINCIAL HEALTH SERVICES AUTHORITY (CA) 2025-10-30 — — US disclosed
US-12280090-B2 Antimicrobial peptides UVIC INDUSTRY PARTNERSHIPS INC. (CA) 2025-04-22 — — US disclosed
US-20220125873-A1 ANTIMICROBIAL PEPTIDES UVIC INDUSTRY PARTNERSHIPS INC. (CA) 2022-04-28 — — US disclosed
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