SCHEMBL28396190

SCHEMBL28396190

COC(=O)CC(=O)C1=CCC(Cl)(Cl)C=C1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 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
SCHEMBL28802427 0.61 CHRM3 (0.35)
SCHEMBL31097019 0.60 CHRM3 (0.35)
SCHEMBL11830121 0.60 L3MBTL1 (0.50) MEN1KMT2AMGAMGAASI
SCHEMBL17533157 0.59 GSK3B (0.32)
SCHEMBL9461843 0.59 MGAM (0.65) MEN1KMT2AMGAMGAASI
SCHEMBL11599653 0.58
SCHEMBL29288243 0.58
SCHEMBL8773099 0.58
SCHEMBL27964975 0.57 MGAM (0.55) MEN1KMT2AMGAMGAASI
SCHEMBL3220189 0.57

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-107698511-B 1, 3-diaryl-5-alkoxy pyrazole compound and preparation method and application thereof 福州大学 2020-05-08 CN disclosed