SCHEMBL28914769

SCHEMBL28914769

NF.c1c[nH]c(Oc2ccc[nH]2)c1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AURKA O14965 1/20 0.36
AURKB Q96GD4 1/20 0.36
INCENP Q9NQS7 1/20 0.36
DAO P14920 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 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
SCHEMBL9651942 0.92 DAO (0.35) AURKAAURKBINCENPDAOHDAC8
Methyl Alcohol SCHEMBL10895232 0.84 DAO (0.36) AURKAAURKBINCENPDAOHDAC8
SCHEMBL79800 0.75 LTA4H (0.50)
SCHEMBL14353589 0.75 MEN1 (0.33)
SCHEMBL28464217 0.75 TSHR (0.33) AURKAAURKBINCENPDAO
SCHEMBL29171477 0.73 LTA4H (0.48)
SCHEMBL9851274 0.71 SLC6A2 (0.40) DAO
SCHEMBL11689102 0.71 CYP3A4 (0.42)
SCHEMBL11386377 0.70
SCHEMBL354072 0.70

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-112930753-A Method for preventing and treating radix sileris root rot or leaf spot disease caused by alternaria alternata 双鸭山东昊农业科技有限责任公司 2021-06-11 CN disclosed