SCHEMBL30725665

SCHEMBL30725665

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 6/20 0.54
▸ BACE2 Q9Y5Z0 3/20 0.54
▸ ACE P12821 6/20 0.52
▸ F2 P00734 2/20 0.51
▸ MME P08473 1/20 0.51
▸ CPA1 P15085 1/20 0.51
▸ ACE2 Q9BYF1 1/20 0.51
▸ OPRM1 P35372 2/20 0.50
▸ OPRD1 P41143 2/20 0.50

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
SCHEMBL30054528 0.95 BACE1 (0.56) BACE1BACE2ACEMMECPA1
SCHEMBL30609017 0.92 BACE1 (0.56) BACE1BACE2ACEMMECPA1
SCHEMBL30272520 0.91 OPRD1 (0.58) ACEMMECPA1ACE2OPRM1
SCHEMBL31643187 0.90 NAALAD2 (0.55) BACE1BACE2ACEF2MME
SCHEMBL31688175 0.90 ACE (0.53) BACE1ACEMMECPA1ACE2
SCHEMBL29857400 0.89 ACE (0.51) BACE1BACE2ACEF2MME
SCHEMBL11886068 0.89 ACE (0.51) BACE1BACE2ACEF2MME
SCHEMBL30542169 0.89 BACE1 (0.54) BACE1BACE2ACEF2MME
SCHEMBL29458786 0.89 ACE (0.51) BACE1BACE2ACEF2MME
SCHEMBL29531717 0.88 BACE1 (0.56) BACE1BACE2OPRM1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250270254-A1 PROBES AND KITS FOR THE EARLY DIAGNOSIS OF DIFUSE LARGE B-CELL LYMPHOMA BOE TECHNOLOGY GROUP CO., LTD. (CN) 2025-08-28 — — US disclosed
CN-117642418-A Probes and kit for early diagnosis of diffuse large B cell lymphoma 京东方科技集团股份有限公司 2024-03-01 — — CN disclosed
WO-2024000262-A1 PROBE AND KIT FOR EARLY DIAGNOSIS OF DIFFUSE LARGE B-CELL LYMPHOMA 京东方科技集团股份有限公司 2024-01-04 — — WO disclosed
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