SCHEMBL7947089

SCHEMBL7947089

COc1ccc(C(=O)c2ccccc2)c(C)c1OC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.62
MAPK1 P28482 4/20 0.62
KDM4E B2RXH2 3/20 0.62
HSD17B10 Q99714 3/20 0.62
ALOX15 P16050 1/20 0.62
LMNA P02545 8/20 0.57
HTT P42858 3/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
NPSR1 Q6W5P4 2/20 0.57
HPGD P15428 5/20 0.53
CYP3A4 P08684 2/20 0.53
RECQL P46063 2/20 0.53
TDP1 Q9NUW8 2/20 0.50
ALDH1A1 P00352 3/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2D6 P10635 2/20 0.49
CYP2C19 P33261 2/20 0.49
KMT2A Q03164 2/20 0.49
PGR P06401 1/20 0.49
SLC6A2 P23975 1/20 0.49

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
SCHEMBL613121 0.90 MAPT (0.66) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL30023422 0.87 MAPT (0.66) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL2446110 0.87 MAPT (0.66) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL28401771 0.85 MAPT (0.64) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL29266730 0.85 MAPT (0.51) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL11496796 0.84 MAPT (0.52) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL6444260 0.84 MAPT (0.77) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL12587771 0.83 MAPT (0.57) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL28349799 0.83 MAPT (0.57) MAPTMAPK1KDM4EHSD17B10ALOX15
SCHEMBL9442995 0.83 MAPT (0.60) MAPTMAPK1KDM4EHSD17B10ALOX15

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
WO-2001062083-A2 FUNGICIDAL MIXTURES BASF AKTIENGESELLSCHAFT (DE) 2001-08-30 WO claimed