SCHEMBL28698965

SCHEMBL28698965

NC(=O)c1nc(OCCCl)cnc1O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 1/20 0.33
APP P05067 1/20 0.32
BACE1 P56817 1/20 0.32
IKBKB O14920 1/20 0.30

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
SCHEMBL30253497 1.00 SIRT6 (0.33) SIRT6APPBACE1IKBKB
SCHEMBL28691237 0.87 IKBKB (0.39) SIRT6IKBKB
SCHEMBL30253592 0.87 IKBKB (0.39) SIRT6IKBKB
SCHEMBL28644566 0.84 SIRT6 (0.36) SIRT6IKBKB
SCHEMBL28707295 0.83 CHEK2 (0.38) SIRT6APPBACE1IKBKB
SCHEMBL30253749 0.83 CHEK2 (0.38) SIRT6APPBACE1IKBKB
SCHEMBL28639557 0.83 LMNA (0.36) SIRT6
SCHEMBL28652992 0.82 MAPT (0.41)
SCHEMBL28685074 0.81 MAPT (0.39) SIRT6IKBKB
SCHEMBL28658057 0.81 MAPT (0.43)

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
CN-113336713-A Preparation method of alkoxy pyrazine derivative and alkoxy pyrazine derivative 中国人民解放军军事科学院军事医学研究院 2021-09-03 CN claimed
CN-113336713-B Preparation method of alkoxy pyrazine derivative and alkoxy pyrazine derivative 中国人民解放军军事科学院军事医学研究院 2023-03-17 CN disclosed
CN-113336713-A Preparation method of alkoxy pyrazine derivative and alkoxy pyrazine derivative 中国人民解放军军事科学院军事医学研究院 2021-09-03 CN disclosed