SCHEMBL31000876

SCHEMBL31000876

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)C(C)C)C(C)C)C(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)C(C)C

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CALCR P30988 4/20 0.61
▸ NPY2R P49146 7/20 0.58
▸ NPY4R P50391 7/20 0.58
▸ NPY5R Q15761 7/20 0.58
▸ NPY1R P25929 5/20 0.58
▸ EP300 Q09472 1/20 0.57
▸ HIF1A Q16665 1/20 0.57
▸ F2 P00734 4/20 0.56
▸ HCRTR1 O43613 1/20 0.56
▸ HCRTR2 O43614 1/20 0.56
▸ NTSR2 O95665 1/20 0.53
▸ NTSR1 P30989 1/20 0.53

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
SCHEMBL30906353 0.91 CALCR (0.59) CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL31000918 0.90 RAMP3 (0.58) CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30831411 0.90 CALCR (0.63) CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30567778 0.89 CALCR (0.66) CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30432136 0.88 F2 (0.64) CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30576913 0.88 CALCR (0.65) CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30432324 0.88 F2 (0.62) CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL29679500 0.88 CALCR (0.64) CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30495751 0.88 CALCR (0.59) CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL31182956 0.88 NPY2R (0.65) CALCRNPY2RNPY4RNPY5RNPY1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4630447-A2 ANTIBODIES OR FRAGMENTS THEREOF FOR SARS-COV-2 AND VARIANTS THEREOF Abwiz Bio, Inc. (US) 2025-10-15 — — EP disclosed
WO-2024124241-A2 ANTIBODIES OR FRAGMENTS THEREOF FOR SARS-COV-2 AND VARIANTS THEREOF ABWIZ BIO, INC. (US) 2024-06-13 — — WO disclosed
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