Juarezic Acid

Juarezic Acid

SCHEMBL9843358

C=CC(=O)OCC(CC)CCCC.C=Cc1ccccc1C=C.O=C(O)C=CC=Cc1ccccc1

nearest known ligand 0.56

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.56
TDP1 Q9NUW8 3/20 0.50
ALDH1A1 P00352 6/20 0.45
CYP3A4 P08684 3/20 0.45
CA2 P00918 1/20 0.45
LMNA P02545 5/20 0.42
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
MAPK1 P28482 3/20 0.40
HSD17B10 Q99714 1/20 0.37
ACHE P22303 1/20 0.36
BACE1 P56817 1/20 0.36
ATM Q13315 1/20 0.36
KDM4E B2RXH2 2/20 0.34
HDAC3 O15379 2/20 0.33
EGFR P00533 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33

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
Juarezic Acid SCHEMBL9843114 0.95 TSHR (0.62) TSHRTDP1ALDH1A1CYP3A4CA2
Styrene SCHEMBL9311792 0.88 TSHR (0.66) TSHRTDP1ALDH1A1CYP3A4CA2
SCHEMBL8656081 0.87 TSHR (0.74) TSHRTDP1ALDH1A1CYP3A4CA2
SCHEMBL31270696 0.84 TDP1 (0.64) TSHRTDP1ALDH1A1CYP3A4CA2
Styrene SCHEMBL491218 0.83 TSHR (0.72) TSHRTDP1ALDH1A1CYP3A4CA2
Styrene SCHEMBL9718415 0.82 TSHR (0.55) TSHRTDP1ALDH1A1CYP3A4CA2
SCHEMBL5924740 0.80 TSHR (0.67) TSHRTDP1ALDH1A1CYP3A4CA2
Styrene SCHEMBL1092186 0.79 TSHR (0.66) TSHRTDP1ALDH1A1CYP3A4CA2
Juarezic Acid SCHEMBL1627203 0.79 TSHR (0.55) TSHRTDP1CYP3A4ACHEATM
Juarezic Acid SCHEMBL8887961 0.79 TSHR (0.55) TSHRTDP1CYP3A4ACHEATM

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
EP-0410483-A1 Developer for developing electrostatic images and image forming apparatus CANON KABUSHIKI KAISHA (JP) 1991-01-30 EP disclosed