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SCHEMBL31544752

SCHEMBL31544752

CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CN)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TFPI P10646 4/20 0.60
▸ MAPK8 P45983 1/20 0.60
▸ MAPK9 P45984 1/20 0.60
▸ MAPK10 P53779 1/20 0.60
▸ NPY2R P49146 7/20 0.60
▸ NPY4R P50391 7/20 0.60
▸ NPY5R Q15761 7/20 0.60
▸ NPY1R P25929 5/20 0.60
▸ NMUR2 Q9GZQ4 3/20 0.59
▸ NMUR1 Q9HB89 3/20 0.59
▸ KEAP1 Q14145 1/20 0.59
▸ OPRD1 P41143 1/20 0.58

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
SCHEMBL30495738 0.96 NPY2R (0.61) TFPIMAPK8MAPK9MAPK10NPY2R
SCHEMBL29588486 0.92 NPY2R (0.65) TFPIMAPK8MAPK9MAPK10NPY2R
SCHEMBL30495701 0.91 NPY2R (0.64) TFPINPY2RNPY4RNPY5RNPY1R
SCHEMBL31182783 0.89 CALCR (0.63) TFPIMAPK8MAPK9MAPK10NPY2R
SCHEMBL31230205 0.89 NPY2R (0.63) TFPIMAPK8MAPK9MAPK10NPY2R
SCHEMBL29509548 0.89 TFPI (0.65) TFPINPY2RNPY4RNPY5RNPY1R
SCHEMBL29525763 0.89 KDM1A (0.63) TFPIMAPK8MAPK9MAPK10NPY2R
Cathelicidin SCHEMBL29350781 0.89 NPY2R (0.65) TFPINPY2RNPY4RNPY5RNPY1R
SCHEMBL31183026 0.89 NPY2R (0.64) TFPINPY2RNPY4RNPY5RNPY1R
SCHEMBL29572169 0.89 MAPK8 (0.59) TFPIMAPK8MAPK9MAPK10NPY2R

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
CN-119925570-A Application of antibacterial peptide CRAMP in preparation of product for inhibiting enterobacteria and/or indirectly promoting growth of lactobacilli 中国农业科学院兰州兽医研究所(中国动物卫生与流行病学中心兰州分中心) 2025-05-06 — — CN disclosed
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