SCHEMBL17859348

SCHEMBL17859348

CC(C)(C)OC(=O)C(N)Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 15/20 0.51
NMBR P28336 1/20 0.41
LTA4H P09960 1/20 0.38
CPB1 P15086 3/20 0.36
CPB2 Q96IY4 3/20 0.36

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
SCHEMBL7368138 1.00 SIRT2 (0.51) SIRT2NMBRLTA4HCPB1CPB2
SCHEMBL29823742 0.89 SIRT2 (0.47) SIRT2NMBRCPB1CPB2
SCHEMBL523065 0.88 SIRT2 (0.60) SIRT2NMBRCPB1CPB2
SCHEMBL10026712 0.88 SIRT2 (0.60) SIRT2NMBRCPB1CPB2
SCHEMBL522051 0.88 SIRT2 (0.60) SIRT2NMBRCPB1CPB2
Hydrochloric Acid SCHEMBL522050 0.87 SIRT2 (0.59) SIRT2NMBRCPB1CPB2
Hydrochloric Acid SCHEMBL523064 0.87 SIRT2 (0.59) SIRT2NMBRCPB1CPB2
Hydrochloric Acid SCHEMBL522052 0.87 SIRT2 (0.59) SIRT2NMBRCPB1CPB2
SCHEMBL21690129 0.84 SIRT2 (0.49) SIRT2CPB1CPB2
SCHEMBL6773700 0.84 SIRT2 (0.49) SIRT2CPB1CPB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119139157-B Hair loss preventing and caring component, preparation method thereof and shampoo 广州市圣莎拉化妆品有限公司 2025-03-07 CN claimed
CN-119139157-A Hair loss preventing and caring component, preparation method thereof and shampoo 广州市圣莎拉化妆品有限公司 2024-12-17 CN claimed
CN-119139157-B Hair loss preventing and caring component, preparation method thereof and shampoo 广州市圣莎拉化妆品有限公司 2025-03-07 CN disclosed
CN-119139157-A Hair loss preventing and caring component, preparation method thereof and shampoo 广州市圣莎拉化妆品有限公司 2024-12-17 CN disclosed
WO-2016096590-A1 SYNTHETIC ENZYME MIMIC BASED ON A HISTIDINE SCAFFOLD UNILEVER PLC (GB) 2016-06-23 WO disclosed