SCHEMBL30456323

SCHEMBL30456323

CC(C)C[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 6/20 0.57
LTA4H P09960 1/20 0.55
MMP2 P08253 1/20 0.55
MMP7 P09237 1/20 0.55
MMP9 P14780 1/20 0.55
MMP12 P39900 1/20 0.55
MMP13 P45452 1/20 0.55
MME P08473 1/20 0.54
MMP1 P03956 1/20 0.53
FCER2 P06734 1/20 0.53

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
SCHEMBL30799379 0.96 BACE1 (0.63) BACE1
SCHEMBL29658147 0.95 BACE1 (0.61) BACE1MMP2MMP7MMP9MMP12
SCHEMBL30463289 0.95 BACE1 (0.61) BACE1MMP2MMP7MMP9MMP12
SCHEMBL30799752 0.94 BACE1 (0.64) BACE1
SCHEMBL30385698 0.92 BACE1 (0.61) BACE1LTA4HMMP2MMP7MMP9
SCHEMBL29819453 0.92 LTA4H (0.56) BACE1LTA4HMMP2MMP7MMP9
SCHEMBL30051537 0.91 LTA4H (0.61) LTA4HMMP2MMP7MMP9MMP12
SCHEMBL30799747 0.91 BACE1 (0.61) BACE1MME
SCHEMBL30516164 0.91 NPY4R (0.60) MME
SCHEMBL5177480 0.91 FCER2 (0.61) BACE1MMP1FCER2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113181355-B DC cell targeted nano SARS-CoV 2S protein polypeptide pool vaccine and its preparation method 大连大学 2024-07-16 CN claimed
CN-118900639-A Composition for controlling proliferation of coliform bacteria and use thereof 株式会社明治 2024-11-05 CN disclosed
CN-118890973-A Composition for controlling proliferation of bacteria in intestinal tract and use thereof 株式会社明治 2024-11-01 CN disclosed
CN-118870990-A Composition for controlling proliferation of bacteria in intestinal tract and use thereof 株式会社明治 2024-10-29 CN disclosed
CN-116716324-A Alkane degradation gene, protein and application thereof 山东省科学院生态研究所(山东省科学院中日友好生物技术研究中心) 2023-09-08 CN disclosed
CN-116144684-A Oyster shell muscle tension related gene and application thereof 中国科学院海洋研究所 2023-05-23 CN disclosed