SCHEMBL31683844

SCHEMBL31683844

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

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 3/20 0.46
▸ C5AR1 P21730 2/20 0.45
▸ CTSL P07711 3/20 0.45
▸ CTSS P25774 3/20 0.45
▸ CTSK P43235 3/20 0.45
▸ CTSH P09668 1/20 0.45
▸ F2 P00734 1/20 0.42
▸ OPRM1 P35372 3/20 0.41

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
SCHEMBL31683847 0.94 C5AR1 (0.44) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL30339898 0.93 CTSL (0.53) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL29630628 0.91 APLNR (0.49) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL29568782 0.90 APLNR (0.46) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL29591975 0.89 APLNR (0.51) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL31096802 0.89 C5AR1 (0.53) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL29607035 0.89 APLNR (0.55) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL29607506 0.88 APLNR (0.56) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL29607754 0.88 APLNR (0.56) APLNRC5AR1CTSLCTSSCTSK
SCHEMBL29607221 0.88 C5AR1 (0.53) APLNRC5AR1CTSLCTSSCTSK

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