SCHEMBL29664292

SCHEMBL29664292

CC[C@H](C)[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 1/20 0.50
▸ NTSR2 O95665 13/20 0.49
▸ NTSR1 P30989 13/20 0.49
▸ SORT1 Q99523 11/20 0.49
▸ CAPN1 P07384 4/20 0.49
▸ CTSB P07858 1/20 0.49
▸ REN P00797 1/20 0.48

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
SCHEMBL29590984 0.89 NTSR2 (0.49) NTSR2NTSR1SORT1CAPN1REN
SCHEMBL30638815 0.88 SLC6A2 (0.53) XIAPNTSR2NTSR1SORT1CAPN1
SCHEMBL29625336 0.85 XIAP (0.53) XIAPNTSR2NTSR1SORT1REN
SCHEMBL29876639 0.84 CAPN1 (0.62) NTSR2NTSR1CAPN1CTSBREN
SCHEMBL30779719 0.84 XIAP (0.51) XIAPNTSR2NTSR1SORT1CAPN1
SCHEMBL2195159 0.83 XIAP (0.54) XIAPNTSR2NTSR1SORT1
SCHEMBL30314935 0.83 KMT2A (0.48) XIAPNTSR2NTSR1SORT1CAPN1
SCHEMBL31295889 0.83 NTSR1 (0.61) NTSR2NTSR1SORT1
SCHEMBL31409133 0.83 CAPN1 (0.53) NTSR2NTSR1SORT1CAPN1CTSB
SCHEMBL31362663 0.82 CAPN1 (0.51) XIAPNTSR2NTSR1SORT1CAPN1

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
EP-3145943-B1 PEPTIDES, COMPOSITIONS COMPRISING THEM AND USES IN PARTICULAR COSMETIC USES SEDERMA SA (FR) 2024-03-13 — — EP disclosed
CN-110742822-B Skin whitening anti-aging composition, whitening anti-aging cream containing same and preparation method thereof 广州环亚化妆品科技有限公司 2022-04-01 — — CN disclosed
Send feedback