SCHEMBL28089974

SCHEMBL28089974

CCc1cc(CN)cc(CC)c1C(=O)C(=O)NNC

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.33
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
KLKB1 P03952 1/20 0.32
LOXL2 Q9Y4K0 2/20 0.31

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
SCHEMBL27908042 0.83 BACE1 (0.34) BACE1MEN1GAAKMT2ALOXL2
SCHEMBL28079730 0.78 MEN1 (0.36) BACE1MEN1GAAKMT2A
SCHEMBL27926107 0.78 BACE1 (0.37) BACE1MEN1GAAKMT2ALOXL2
SCHEMBL27925977 0.76 BACE1 (0.36) BACE1MEN1GAAKMT2ALOXL2
SCHEMBL27926083 0.76 GAA (0.40) MEN1GAAKMT2A
SCHEMBL27926223 0.75 HTT (0.35) BACE1MEN1GAAKMT2A
SCHEMBL27992124 0.75 MEN1 (0.40) MEN1GAAKMT2A
SCHEMBL27926018 0.72 BACE1 (0.33) BACE1
SCHEMBL27992341 0.69 BACE1 (0.36) BACE1MEN1GAAKMT2ALOXL2
SCHEMBL458213 0.66 KDM4E (0.38) MEN1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104277004-B Prepare method and its intermediate of pyridazinone compound 住友化学株式会社 2016-08-24 CN disclosed