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SCHEMBL30539396

SCHEMBL30539396

CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NTSR1 P30989 13/20 0.53
▸ NTSR2 O95665 12/20 0.53
▸ F2 P00734 4/20 0.51
▸ SORT1 Q99523 10/20 0.51
▸ REN P00797 1/20 0.51
▸ CALCR P30988 2/20 0.49

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
SCHEMBL31319372 0.93 F2 (0.52) NTSR1NTSR2F2SORT1REN
SCHEMBL29742950 0.89 CALCR (0.57) NTSR1NTSR2F2SORT1CALCR
SCHEMBL31257029 0.88 F2 (0.48) NTSR1NTSR2F2SORT1REN
SCHEMBL30168719 0.88 F2 (0.53) NTSR1NTSR2F2SORT1REN
SCHEMBL31319367 0.88 REN (0.53) NTSR1NTSR2F2SORT1REN
SCHEMBL30422183 0.88 F2 (0.45) NTSR1NTSR2F2REN
SCHEMBL30512749 0.87 NPY2R (0.55) CALCR
SCHEMBL30827585 0.87 MC4R (0.46) F2
SCHEMBL30262170 0.85 F2 (0.56) NTSR1NTSR2F2SORT1REN
SCHEMBL29590586 0.85 F2 (0.48) NTSR1NTSR2F2SORT1REN

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
CN-116693606-A Antibacterial polypeptide and application thereof, bacterial growth inhibitor, anti-inflammatory drug or health care product 中国科学院大连化学物理研究所 2023-09-05 — — CN claimed
CN-116693606-A Antibacterial polypeptide and application thereof, bacterial growth inhibitor, anti-inflammatory drug or health care product 中国科学院大连化学物理研究所 2023-09-05 — — CN disclosed
CN-116693606-A Antibacterial polypeptide and application thereof, bacterial growth inhibitor, anti-inflammatory drug or health care product 中国科学院大连化学物理研究所 2023-09-05 — — CN disclosed
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