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SCHEMBL29416095

SCHEMBL29416095

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY1R P25929 1/20 0.71
▸ NPY2R P49146 1/20 0.71
▸ NPY4R P50391 1/20 0.71
▸ NPY5R Q15761 1/20 0.71
▸ GLP1R P43220 12/20 0.68
▸ CCKBR P32239 2/20 0.68
▸ CALCR P30988 4/20 0.68
▸ C5AR1 P21730 1/20 0.66
▸ GCGR P47871 1/20 0.65

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
SCHEMBL30692442 1.00 NPY1R (0.71) NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30646306 1.00 NPY1R (0.72) NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL29991271 0.95 GLP1R (0.73) NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30721558 0.94 NPY1R (0.72) NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30658209 0.94 NPY1R (0.73) NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30721620 0.94 NPY1R (0.72) NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL31182708 0.94 NPY1R (0.71) NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30721629 0.94 GLP1R (0.70) NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30721578 0.93 NPY1R (0.71) NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30721577 0.93 NPY1R (0.71) NPY1RNPY2RNPY4RNPY5RGLP1R

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-116785403-A Neurofilament peptides for preventing or slowing the progression of prostate cancer 尼莫克斯股份有限公司 2023-09-22 — — CN disclosed
CN-109310732-B Neurofilament peptides for preventing or slowing the progression of prostate cancer 尼莫克斯股份有限公司 2023-07-21 — — CN disclosed
CN-114099636-A Method of treating a condition requiring cell destruction or removal using peptides derived from neurofilament proteins 尼莫克斯制药公司 2022-03-01 — — CN disclosed
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