SCHEMBL25575375

SCHEMBL25575375

CC(C)(C)/N=C(\c1ccccc1)C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
ATM Q13315 1/20 0.35
ALDH1A1 P00352 5/20 0.35
TSHR P16473 3/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ELANE P08246 2/20 0.35
SIGMAR1 Q99720 2/20 0.34
ESRRG P62508 1/20 0.34
LMNA P02545 3/20 0.33
CES2 O00748 2/20 0.33
CES1 P23141 2/20 0.33
DAO P14920 1/20 0.33
NAPRT Q6XQN6 1/20 0.33
POLB P06746 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALOX15 P16050 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL22512523 0.79 GAA (0.48) GAAATMALDH1A1TSHRHSD17B10
SCHEMBL28541958 0.79 GAA (0.64) GAAATMALDH1A1TSHRHSD17B10
Fluoride SCHEMBL27890616 0.77 GAA (0.62) GAAATMALDH1A1TSHRHSD17B10
SCHEMBL30762076 0.76 ALDH1A1 (0.41) GAAATMALDH1A1TSHRHSD17B10
SCHEMBL10298145 0.76 ALDH1A1 (0.41) GAAATMALDH1A1TSHRHSD17B10
SCHEMBL5686247 0.74 LMNA (0.47) GAAATMALDH1A1HSD17B10TDP1
SCHEMBL5686249 0.74 LMNA (0.47) GAAATMALDH1A1HSD17B10TDP1
SCHEMBL22951449 0.74 LMNA (0.47) GAAATMALDH1A1HSD17B10TDP1
SCHEMBL3069246 0.74 GAA (0.44) GAAATMALDH1A1TSHRHSD17B10
SCHEMBL3069249 0.74 GAA (0.44) GAAATMALDH1A1TSHRHSD17B10

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
US-20230170473-A1 SOLVENTS AND CATALYST PREPARATIONS FOR LITHIUM-OXYGEN BATTERIES UCHICAGO ARGONNE, LLC (US) 2023-06-01 US disclosed