SCHEMBL28688010

SCHEMBL28688010

CC(C)(C)c1ccc(C(=O)c2ccccc2)c(O)c1C(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
MAPK1 P28482 2/20 0.50
KDM4E B2RXH2 2/20 0.50
ALOX15 P16050 1/20 0.50
HSD17B10 Q99714 1/20 0.50
GAA P10253 2/20 0.44
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
KMT2A Q03164 1/20 0.44
KEAP1 Q14145 1/20 0.44
NFE2L2 Q16236 1/20 0.44
TNFRSF1A P19438 1/20 0.42
ALDH1A1 P00352 2/20 0.42
ELANE P08246 2/20 0.42
LMNA P02545 2/20 0.42
HTT P42858 2/20 0.42
CYP1A2 P05177 1/20 0.42
PGR P06401 1/20 0.42
CYP2D6 P10635 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL28397888 0.85 ELANE (0.43) MAPTMAPK1KDM4EALOX15HSD17B10
SCHEMBL8420546 0.83 TNFRSF1A (0.48) MAPTMAPK1KDM4EALOX15HSD17B10
SCHEMBL28136021 0.83 MAPT (0.46) MAPTKDM4EHSD17B10GAAMEN1
SCHEMBL332091 0.81 GLRA3 (0.46) MAPTKDM4EHSD17B10TNFRSF1AALDH1A1
SCHEMBL8362268 0.81 TDP1 (0.38) MAPTMAPK1KDM4EALOX15HSD17B10
SCHEMBL27489647 0.80 AKR1C3 (0.48) MAPTHSD17B10GAAMEN1USP2
SCHEMBL12983473 0.80 CA2 (0.53) MAPTMAPK1KDM4EALOX15HSD17B10
SCHEMBL9080891 0.80 GLRA3 (0.44) MAPTKDM4EHSD17B10TNFRSF1AALDH1A1
SCHEMBL8340705 0.80 GLRA3 (0.44) MAPTKDM4EHSD17B10TNFRSF1AALDH1A1
SCHEMBL1406034 0.80 GLRA3 (0.44) MAPTKDM4EHSD17B10TNFRSF1AALDH1A1

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-113766874-A Non-invasive continuous blood glucose monitor 奥博士科技有限公司 2021-12-07 CN disclosed