SCHEMBL28615527

SCHEMBL28615527

CC(C)(C)OOC=CC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.36
TP53 P04637 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36
EGLN3 Q9H6Z9 1/20 0.36
HCAR2 Q8TDS4 4/20 0.36
TDP1 Q9NUW8 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GABRP O00591 2/20 0.30
GABRD O14764 2/20 0.30
GABRA1 P14867 2/20 0.30
GABRB1 P18505 2/20 0.30
GABRG2 P18507 2/20 0.30
GABRB3 P28472 2/20 0.30
GABRA5 P31644 2/20 0.30
GABRA3 P34903 2/20 0.30
GABRA2 P47869 2/20 0.30
GABRB2 P47870 2/20 0.30
GABRA4 P48169 2/20 0.30
GABRE P78334 2/20 0.30

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
Maleic Acid SCHEMBL2804945 0.79 TSHR (0.53) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL9380769 0.79 TSHR (0.53) TSHRTP53EGLN1EGLN3HCAR2
Bicarbonate SCHEMBL27993555 0.76 TSHR (0.32) TSHRTDP1ALDH1A1HSD17B10
SCHEMBL29156827 0.74 TSHR (0.31) TSHRTDP1ALDH1A1HSD17B10
SCHEMBL464854 0.74 HCAR2 (0.39) TSHRTP53HCAR2ALDH1A1HSD17B10
SCHEMBL7685958 0.74
Crotonic Acid SCHEMBL27676453 0.73 TSHR (0.40) TSHRTP53EGLN1EGLN3HCAR2
SCHEMBL28670809 0.71 TSHR (0.32) TSHRTDP1
SCHEMBL8526173 0.71
SCHEMBL9250932 0.71 HCAR2 (0.31) HCAR2

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-113316610-A Ethylene propylene diene copolymer composites for laminates 埃克森美孚化学专利公司 2021-08-27 CN disclosed