SCHEMBL30093064

SCHEMBL30093064

CC(C)[C@H](N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(C)C

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 2/20 0.53
▸ CTSL P07711 3/20 0.47
▸ CTSS P25774 3/20 0.47
▸ CTSK P43235 3/20 0.47
▸ CTSH P09668 1/20 0.47
▸ GLP1R P43220 5/20 0.47
▸ CD47 Q08722 1/20 0.47
▸ IL23R Q5VWK5 4/20 0.47
▸ KISS1R Q969F8 2/20 0.46
▸ MC4R P32245 2/20 0.46

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
SCHEMBL30093066 1.00 C5AR1 (0.53) C5AR1CTSLCTSSCTSKCTSH
SCHEMBL30092961 0.96 C5AR1 (0.50) C5AR1CTSLCTSSCTSKCTSH
SCHEMBL30130533 0.95 C5AR1 (0.55) C5AR1CTSLCTSSCTSKCTSH
SCHEMBL30093071 0.93 C5AR1 (0.54) C5AR1CTSLCTSSCTSKCTSH
SCHEMBL30798752 0.92 IL23R (0.51) IL23RKISS1R
SCHEMBL30305362 0.92 IL23R (0.51) IL23RKISS1R
SCHEMBL30093039 0.92 IL23R (0.51) IL23RKISS1R
SCHEMBL30302936 0.92 IL23R (0.51) IL23RKISS1R
SCHEMBL30339793 0.92 IL23R (0.51) IL23RKISS1R
SCHEMBL30302924 0.92 IL23R (0.51) IL23RKISS1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115397836-A Novel antibacterial peptide and application thereof 安尼根有限公司 2022-11-25 — — CN claimed
CN-115397836-A Novel antibacterial peptide and application thereof 安尼根有限公司 2022-11-25 — — CN disclosed
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