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SCHEMBL30648446

SCHEMBL30648446

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

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 7/20 0.58
▸ NPY4R P50391 7/20 0.58
▸ NPY5R Q15761 7/20 0.58
▸ NPY1R P25929 5/20 0.58
▸ CALCR P30988 11/20 0.57
▸ RAMP3 O60896 8/20 0.57
▸ EP300 Q09472 1/20 0.57
▸ HIF1A Q16665 1/20 0.57

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
SCHEMBL30277957 0.95 NPY2R (0.58) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL29479782 0.94 EP300 (0.60) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30906352 0.94 NPY2R (0.59) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30648467 0.94 NPY2R (0.57) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL31683337 0.92 NPY2R (0.61) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30478749 0.92 CALCR (0.56) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL31683366 0.92 CALCR (0.56) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30429234 0.92 EP300 (0.62) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL29827221 0.91 NPY2R (0.59) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30495607 0.90 NPY2R (0.64) NPY2RNPY4RNPY5RNPY1RCALCR

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
CN-116948034-B Active type heterophagy antibody blocker Block-5S and preparation method thereof 南京珀尔泰生物技术有限公司 2024-06-25 — — CN disclosed
CN-116948034-A Active type heterophagy antibody blocker Block-5S and preparation method thereof 南京珀尔泰生物技术有限公司 2023-10-27 — — CN disclosed
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