SCHEMBL31441459

SCHEMBL31441459

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 1/20 0.65
▸ GLP1R P43220 18/20 0.64
▸ CCKBR P32239 1/20 0.60

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
SCHEMBL30979202 0.95 GLP1R (0.64) KEAP1GLP1RCCKBR
SCHEMBL31743241 0.94 GLP1R (0.67) GLP1R
SCHEMBL31743239 0.94 GLP1R (0.68) GLP1R
SCHEMBL30387584 0.93 GLP1R (0.65) KEAP1GLP1RCCKBR
SCHEMBL30970990 0.93 GLP1R (0.71) GLP1RCCKBR
SCHEMBL30637773 0.92 GLP1R (0.67) GLP1R
SCHEMBL29520076 0.92 GLP1R (0.67) KEAP1GLP1RCCKBR
SCHEMBL31182663 0.92 CALCR (0.63) KEAP1GLP1RCCKBR
SCHEMBL31243560 0.92 CALCR (0.59) KEAP1GLP1RCCKBR
SCHEMBL29939727 0.92 GLP1R (0.72) GLP1RCCKBR

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
US-20250136657-A1 METHOD FOR ADJUSTING A PARENTERAL SUPPORT (PS) VOLUME IN A HUMAN SUBJECT ZEALAND PHARMA A/S (DK) 2025-05-01 — — US disclosed
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