SCHEMBL31468796

SCHEMBL31468796

C[C@@H](O)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 12/20 0.64
▸ IL23R Q5VWK5 4/20 0.64
▸ C5AR1 P21730 1/20 0.58
▸ NPY1R P25929 1/20 0.55
▸ NPY2R P49146 1/20 0.55
▸ NPY4R P50391 1/20 0.55
▸ NPY5R Q15761 1/20 0.55
▸ CTNNB1 P35222 1/20 0.54

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
SCHEMBL29973644 0.98 KISS1R (0.66) KISS1RIL23RC5AR1NPY1RNPY2R
SCHEMBL31410855 0.95 KISS1R (0.65) KISS1RIL23RC5AR1NPY1RNPY2R
SCHEMBL30268594 0.94 IL23R (0.66) KISS1RIL23RC5AR1NPY1RNPY2R
SCHEMBL34470137 0.91 KISS1R (0.67) KISS1RIL23RC5AR1NPY1RNPY2R
SCHEMBL31331997 0.91 KISS1R (0.62) KISS1RIL23RC5AR1NPY1RNPY2R
SCHEMBL31729497 0.90 SLC6A2 (0.62) KISS1RIL23RC5AR1
SCHEMBL29772142 0.89 KISS1R (0.64) KISS1RIL23RC5AR1
SCHEMBL31307225 0.89 IL23R (0.65) KISS1RIL23RC5AR1NPY1RNPY2R
SCHEMBL13319650 0.88 IL23R (0.63) KISS1RIL23RC5AR1NPY1RNPY2R
SCHEMBL29725113 0.88 IL23R (0.62) KISS1RIL23RC5AR1NPY1RNPY2R

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-119661637-A Polypeptide with ACE (angiotensin converting enzyme) inhibitory activity and application thereof 三亚热带水产研究院 2025-03-21 — — CN disclosed
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