SCHEMBL29428971

SCHEMBL29428971

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

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 2/20 0.66
▸ MC4R P32245 2/20 0.62
▸ MC5R P33032 2/20 0.62
▸ MC3R P41968 2/20 0.62
▸ MC1R Q01726 2/20 0.62
▸ OPRD1 P41143 7/20 0.60
▸ OPRM1 P35372 4/20 0.60
▸ IL23R Q5VWK5 1/20 0.57
▸ KISS1R Q969F8 1/20 0.56
▸ NPY1R P25929 1/20 0.56
▸ NPY2R P49146 1/20 0.56
▸ NPY4R P50391 1/20 0.56
▸ NPY5R Q15761 1/20 0.56
▸ TACR1 P25103 1/20 0.56
▸ CXCR4 P61073 4/20 0.56
▸ NMUR2 Q9GZQ4 1/20 0.56
▸ NMUR1 Q9HB89 1/20 0.56
▸ CXCL8 P10145 1/20 0.55

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
SCHEMBL30575503 0.93 C5AR1 (0.59) C5AR1MC4RMC5RMC3RMC1R
SCHEMBL30371655 0.89 CXCR4 (0.60) C5AR1MC4RMC5RMC3RMC1R
SCHEMBL30439395 0.89 OPRD1 (0.67) C5AR1OPRD1IL23RNPY1RNPY2R
SCHEMBL30432210 0.88 C5AR1 (0.66) C5AR1MC4RMC5RMC3RMC1R
SCHEMBL31430442 0.87 C5AR1 (0.62) C5AR1MC4RMC5RMC3RMC1R
SCHEMBL29556709 0.87 C5AR1 (0.61) C5AR1MC4RMC5RMC3RMC1R
SCHEMBL30571131 0.87 C5AR1 (0.59) C5AR1OPRM1KISS1RCXCL8
SCHEMBL29725113 0.86 IL23R (0.62) C5AR1MC4RMC5RMC3RMC1R
SCHEMBL29656083 0.86 C5AR1 (0.61) C5AR1MC4RMC5RMC3RMC1R
SCHEMBL29697189 0.86 KISS1R (0.65) C5AR1MC4RMC5RMC3RMC1R

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114044807-B Mussel hypolipidemic oligopeptide for treating hyperlipidemia 浙江海洋大学 2023-08-22 — — CN claimed
CN-114044807-A Mussel blood fat reducing oligopeptide for treating hyperlipidemia 浙江海洋大学 2022-02-15 — — CN claimed
CN-114044807-B Mussel hypolipidemic oligopeptide for treating hyperlipidemia 浙江海洋大学 2023-08-22 — — CN disclosed
CN-114044807-B Mussel hypolipidemic oligopeptide for treating hyperlipidemia 浙江海洋大学 2023-08-22 — — CN disclosed
CN-114044807-A Mussel blood fat reducing oligopeptide for treating hyperlipidemia 浙江海洋大学 2022-02-15 — — CN disclosed
CN-114044807-A Mussel blood fat reducing oligopeptide for treating hyperlipidemia 浙江海洋大学 2022-02-15 — — CN disclosed
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