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SCHEMBL29868686

SCHEMBL29868686

CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)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](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)[C@@H](C)O)C(C)C

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 10/20 0.68
▸ NPY4R P50391 8/20 0.68
▸ NPY5R Q15761 8/20 0.68
▸ NPY1R P25929 6/20 0.68
▸ CALCR P30988 5/20 0.65
▸ EP300 Q09472 1/20 0.62
▸ HIF1A Q16665 1/20 0.62
▸ KDM1A O60341 1/20 0.62
▸ MAPK8 P45983 1/20 0.61
▸ MAPK9 P45984 1/20 0.61
▸ MAPK10 P53779 1/20 0.61
▸ F2 P00734 1/20 0.60
▸ RAMP1 O60894 1/20 0.60
▸ RAMP2 O60895 1/20 0.60
▸ RAMP3 O60896 1/20 0.60
▸ CALCRL Q16602 1/20 0.60

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
SCHEMBL29868596 0.95 CALCR (0.69) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL29496288 0.92 NPY2R (0.74) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL13248707 0.91 NPY2R (0.80) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL31182661 0.90 F2 (0.65) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL29397746 0.90 NPY2R (0.73) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL29496391 0.89 NPY2R (0.72) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL29604989 0.89 KEAP1 (0.57) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL31744322 0.88 CALCR (0.77) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30001037 0.88 CALCR (0.78) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL29975560 0.87 NPY2R (0.69) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3720872-B1 ANALOGUES OF PYY IP2IPO INNOVATIONS LTD (GB) 2026-03-25 — — EP disclosed
US-12060402-B2 Analogues of PYY IP2IPO INNOVATIONS LIMITED (GB) 2024-08-13 — — US disclosed
CN-111727198-B Pyy analogues IP2IPO创新有限公司 2024-07-09 — — CN disclosed
US-11421012-B2 Analogues of PYY IP2IPO INNOVATIONS LIMITED (GB) 2022-08-23 — — US disclosed
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