SCHEMBL31683847

SCHEMBL31683847

N=C(N)NCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 1/20 0.44
▸ CTSL P07711 3/20 0.44
▸ CTSS P25774 3/20 0.44
▸ CTSK P43235 3/20 0.44
▸ CTSH P09668 1/20 0.44
▸ APLNR P35414 3/20 0.44
▸ NTSR2 O95665 3/20 0.41
▸ NTSR1 P30989 3/20 0.41
▸ SORT1 Q99523 3/20 0.41
▸ OPRM1 P35372 3/20 0.40
▸ F2 P00734 1/20 0.40
▸ TRHR P34981 1/20 0.39

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
SCHEMBL31683844 0.94 APLNR (0.46) C5AR1CTSLCTSSCTSKCTSH
SCHEMBL29607221 0.92 C5AR1 (0.53) C5AR1CTSLCTSSCTSKCTSH
SCHEMBL9295105 0.90 C5AR1 (0.52) C5AR1CTSLCTSSCTSKCTSH
SCHEMBL7195147 0.90 APLNR (0.50) C5AR1CTSLCTSSCTSKCTSH
SCHEMBL7195144 0.90 APLNR (0.50) C5AR1CTSLCTSSCTSKCTSH
SCHEMBL29607931 0.89 C5AR1 (0.55) C5AR1CTSLCTSSCTSKCTSH
SCHEMBL31096802 0.88 C5AR1 (0.53) C5AR1CTSLCTSSCTSKCTSH
SCHEMBL30364356 0.88 APLNR (0.48) C5AR1CTSLCTSSCTSKCTSH
SCHEMBL29607540 0.88 C5AR1 (0.56) C5AR1CTSLCTSSCTSKCTSH
SCHEMBL30339898 0.88 CTSL (0.53) C5AR1CTSLCTSSCTSKCTSH

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
US-12415839-B2 IgE epitope-like peptides and uses thereof Univerza v Ljubjani (SI) 2025-09-16 — — US disclosed
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