SCHEMBL29015812

SCHEMBL29015812

CC(C)(C)c1cc(CNc2ccccc2)cc(C(C)(C)C)c1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSR P00390 2/20 0.53
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
GAA P10253 3/20 0.51
SCN2A Q99250 2/20 0.47
ALDH1A1 P00352 3/20 0.46
TSHR P16473 3/20 0.46
LMNA P02545 2/20 0.46
HIF1A Q16665 4/20 0.45
CYP1A2 P05177 3/20 0.45
CYP3A4 P08684 3/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
MAPK1 P28482 2/20 0.45
BLM P54132 2/20 0.45
ATM Q13315 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
GMNN O75496 1/20 0.45
GABBR2 O75899 1/20 0.45
TP53 P04637 1/20 0.45

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
SCHEMBL784941 0.94 GAA (0.50) GSRMEN1KMT2AGAASCN2A
SCHEMBL784975 0.94 GAA (0.50) GSRMEN1KMT2AGAASCN2A
SCHEMBL14493851 0.94 GAA (0.50) GSRMEN1KMT2AGAASCN2A
SCHEMBL784945 0.94 GAA (0.50) GSRMEN1KMT2AGAASCN2A
SCHEMBL12377559 0.90 MEN1 (0.47) GSRMEN1KMT2AGAASCN2A
SCHEMBL9708863 0.87 GAA (0.48) GSRMEN1KMT2AGAAALDH1A1
SCHEMBL16104894 0.86 GSR (0.59) GSRMEN1KMT2AGAASCN2A
SCHEMBL16471746 0.86 GAA (0.46) GSRMEN1KMT2AGAASCN2A
SCHEMBL2741253 0.86 MEN1 (0.43) GSRMEN1KMT2AGAASCN2A
SCHEMBL2783563 0.86 MEN1 (0.43) GSRMEN1KMT2AGAASCN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118511314-A Positive electrode material and preparation method thereof, positive electrode composite material and preparation method thereof, secondary battery and electricity utilization device 宁德时代新能源科技股份有限公司 2024-08-16 CN claimed
WO-2024045028-A1 POSITIVE ELECTRODE MATERIAL AND PREPARATION METHOD THEREFOR, POSITIVE ELECTRODE COMPOSITE MATERIAL AND PREPARATION METHOD THEREFOR, SECONDARY BATTERY, AND ELECTRIC DEVICE 宁德时代新能源科技股份有限公司 2024-03-07 WO claimed
CN-118511314-A Positive electrode material and preparation method thereof, positive electrode composite material and preparation method thereof, secondary battery and electricity utilization device 宁德时代新能源科技股份有限公司 2024-08-16 CN disclosed
CN-116250044-A Systems and methods for measuring, learning, and using emerging properties of complex adaptive systems 埃梅里亚公司 2023-06-09 CN disclosed