SCHEMBL31518676

SCHEMBL31518676

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 1/20 0.49
▸ NTSR1 P30989 11/20 0.41
▸ NTSR2 O95665 9/20 0.41
▸ SORT1 Q99523 8/20 0.41
▸ POLB P06746 1/20 0.41
▸ REN P00797 1/20 0.40
▸ OPRD1 P41143 2/20 0.40
▸ SLC6A2 P23975 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
SCHEMBL31518650 0.90 XIAP (0.49) XIAPNTSR1NTSR2SORT1POLB
SCHEMBL31518656 0.90 NTSR1 (0.44) NTSR1NTSR2SORT1SLC6A2
SCHEMBL31518659 0.87 XIAP (0.43) XIAPNTSR1NTSR2SLC6A2
SCHEMBL29381187 0.86 XIAP (0.43) XIAPNTSR1NTSR2SORT1OPRD1
SCHEMBL31518644 0.85 NTSR1 (0.43) NTSR1NTSR2SORT1SLC6A2
SCHEMBL29976151 0.85 CALCRL (0.44) XIAPNTSR1NTSR2SORT1REN
SCHEMBL31518661 0.84 CAPN1 (0.43) XIAPNTSR1NTSR2SORT1SLC6A2
SCHEMBL31518655 0.83 CAPN1 (0.44) XIAPNTSR1NTSR2
SCHEMBL30631601 0.82 DPP4 (0.46) XIAPNTSR1NTSR2POLBREN
SCHEMBL30631602 0.82 DPP4 (0.46) XIAPNTSR1NTSR2POLBREN

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
WO-2025098490-A1 POLYPEPTIDE AND USE THEREOF 四川好医生攀西药业有限责任公司 2025-05-15 — — WO claimed
WO-2025098490-A1 POLYPEPTIDE AND USE THEREOF 四川好医生攀西药业有限责任公司 2025-05-15 — — WO disclosed
Send feedback