SCHEMBL28535594

SCHEMBL28535594

CCCCC(C)CCCCCCCOC(C)=O

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.61
ACE2 Q9BYF1 1/20 0.50
ALOX15 P16050 1/20 0.46
TSHR P16473 2/20 0.46
NAAA Q02083 1/20 0.46
EPHX1 P07099 1/20 0.43
FAAH O00519 1/20 0.42
ACHE P22303 6/20 0.42
PLA2G2C Q5R387 1/20 0.41
ZDHHC7 Q9NXF8 1/20 0.41

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
SCHEMBL30704815 1.00 ALDH1A1 (0.61) ALDH1A1ACE2ALOX15TSHRNAAA
SCHEMBL28525896 0.96 ALDH1A1 (0.61) ALDH1A1ACE2ALOX15TSHRNAAA
SCHEMBL1300593 0.92 ALDH1A1 (0.65) ALDH1A1ACE2ALOX15TSHRNAAA
SCHEMBL15149621 0.92 ALDH1A1 (0.52) ALDH1A1ACE2ALOX15TSHRNAAA
SCHEMBL14525662 0.89 ALDH1A1 (0.55) ALDH1A1ACE2ALOX15TSHRNAAA
SCHEMBL27692304 0.89 ALDH1A1 (0.55) ALDH1A1ACE2ALOX15TSHRNAAA
SCHEMBL6106385 0.89 ALDH1A1 (0.59) ALDH1A1ACE2ALOX15TSHRFAAH
SCHEMBL756657 0.87 ALDH1A1 (0.52) ALDH1A1ACE2ALOX15TSHRNAAA
SCHEMBL1301124 0.87 ALDH1A1 (0.52) ALDH1A1ACE2ALOX15TSHRNAAA
SCHEMBL368275 0.87 ALDH1A1 (0.52) ALDH1A1ACE2ALOX15TSHRNAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107920507-B Granular pesticide composition 组合化学工业株式会社 2021-05-14 CN disclosed
CN-107949278-B Granular pesticide composition 组合化学工业株式会社 2021-01-15 CN disclosed