SCHEMBL31409175

SCHEMBL31409175

CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 2/20 0.53
▸ NTSR2 O95665 6/20 0.52
▸ NTSR1 P30989 6/20 0.52
▸ SORT1 Q99523 6/20 0.52
▸ APLNR P35414 2/20 0.50
▸ REN P00797 5/20 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
SCHEMBL16212659 0.93 C5AR1 (0.54) C5AR1NTSR2NTSR1SORT1APLNR
SCHEMBL30504860 0.93 C5AR1 (0.52) C5AR1NTSR2NTSR1SORT1APLNR
SCHEMBL30537456 0.92 APLNR (0.55) C5AR1NTSR2NTSR1SORT1APLNR
SCHEMBL29607182 0.91 C5AR1 (0.56) C5AR1NTSR2NTSR1SORT1APLNR
SCHEMBL29607221 0.91 C5AR1 (0.53) C5AR1APLNR
SCHEMBL30974380 0.89 C5AR1 (0.62) C5AR1NTSR2NTSR1SORT1APLNR
SCHEMBL29608118 0.89 C5AR1 (0.59) C5AR1NTSR2NTSR1SORT1APLNR
SCHEMBL29608007 0.89 C5AR1 (0.59) C5AR1NTSR2NTSR1SORT1APLNR
SCHEMBL29607540 0.88 C5AR1 (0.56) C5AR1APLNR
SCHEMBL29608041 0.88 C5AR1 (0.58) C5AR1NTSR2NTSR1SORT1APLNR

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-119320439-A Cow milk endogenous antibacterial peptide and application thereof 中国科学院大连化学物理研究所 2025-01-17 — — CN claimed
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