SCHEMBL29800257

SCHEMBL29800257

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 3/20 0.52
▸ MAGI3 Q5TCQ9 1/20 0.52
▸ EDNRA P25101 1/20 0.51
▸ PRMT1 Q99873 1/20 0.51
▸ RXFP1 Q9HBX9 1/20 0.50
▸ NPBWR1 P48145 1/20 0.50
▸ PTH1R Q03431 1/20 0.49
▸ IL23R Q5VWK5 3/20 0.49
▸ NPY2R P49146 2/20 0.49
▸ NPY1R P25929 1/20 0.49
▸ NPY4R P50391 1/20 0.49
▸ KEAP1 Q14145 1/20 0.49
▸ PCSK9 Q8NBP7 1/20 0.49
▸ PRKACB P22694 1/20 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
SCHEMBL29847744 0.97 MAGI3 (0.53) GHSRMAGI3RXFP1PTH1RIL23R
SCHEMBL30130532 0.96 MAGI3 (0.54) MAGI3EDNRAPRMT1NPY2RNPY1R
SCHEMBL30130552 0.96 RXFP1 (0.54) GHSRMAGI3RXFP1NPBWR1PTH1R
SCHEMBL30130583 0.95 PCSK9 (0.54) GHSREDNRARXFP1NPBWR1PTH1R
SCHEMBL30130534 0.95 PCSK9 (0.54) GHSREDNRARXFP1NPBWR1PTH1R
SCHEMBL30093043 0.95 PCSK9 (0.54) GHSREDNRARXFP1NPBWR1PTH1R
SCHEMBL30130544 0.95 PCSK9 (0.54) GHSREDNRARXFP1NPBWR1PTH1R
SCHEMBL30093124 0.95 RXFP1 (0.53) GHSRRXFP1NPBWR1IL23R
SCHEMBL30092978 0.95 EDNRA (0.55) MAGI3EDNRAPRMT1NPY2RNPY1R
SCHEMBL30093025 0.95 EDNRA (0.55) GHSREDNRARXFP1NPBWR1PTH1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114921318-B Multi-cell microfluidic platform and high-throughput screening method thereof 华南理工大学 2025-04-29 — — CN claimed
CN-117683084-A Novel polypeptide coupled drug compound and preparation method and application thereof 中南大学 2024-03-12 — — CN claimed
CN-114921318-A Multi-cell microfluidic platform and high-throughput screening method thereof 华南理工大学 2022-08-19 — — CN claimed
EP-4595948-A1 BMNPS AND NANOASSEMBLIES THEREOF Universidad de Granada (ES) 2025-08-06 — — EP disclosed
CN-114921318-B Multi-cell microfluidic platform and high-throughput screening method thereof 华南理工大学 2025-04-29 — — CN disclosed
CN-117683084-A Novel polypeptide coupled drug compound and preparation method and application thereof 中南大学 2024-03-12 — — CN disclosed
CN-114921318-A Multi-cell microfluidic platform and high-throughput screening method thereof 华南理工大学 2022-08-19 — — CN disclosed
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