SCHEMBL31729497

SCHEMBL31729497

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

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.62
▸ KISS1R Q969F8 6/20 0.59
▸ C5AR1 P21730 2/20 0.59
▸ IL23R Q5VWK5 1/20 0.56
▸ DPP3 Q9NY33 2/20 0.53
▸ EPHA2 P29317 1/20 0.52

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
SCHEMBL31430442 0.93 C5AR1 (0.62) SLC6A2KISS1RC5AR1IL23RDPP3
SCHEMBL30565410 0.92 C5AR1 (0.56) SLC6A2KISS1RC5AR1IL23RDPP3
SCHEMBL31468796 0.90 KISS1R (0.64) KISS1RC5AR1IL23R
SCHEMBL30598997 0.89 IL23R (0.62) KISS1RC5AR1IL23REPHA2
SCHEMBL29973644 0.89 KISS1R (0.66) SLC6A2KISS1RC5AR1IL23R
SCHEMBL30301165 0.89 C5AR1 (0.67) SLC6A2KISS1RC5AR1IL23R
SCHEMBL30205377 0.88 CXCR4 (0.61) SLC6A2KISS1RC5AR1IL23R
SCHEMBL30268594 0.88 IL23R (0.66) KISS1RC5AR1IL23RDPP3
SCHEMBL30716436 0.88 KISS1R (0.63) KISS1RC5AR1IL23RDPP3
SCHEMBL30582469 0.88 CTSL (0.57) KISS1RC5AR1DPP3

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-120943894-A Bovine whey-derived small molecule peptide and application thereof 昆明理工大学 2025-11-14 — — CN disclosed
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