Ethyl Citronellyl Phopshorochloridothionate

Ethyl Citronellyl Phopshorochloridothionate

SCHEMBL8844308

CCOP(=S)(Cl)OCCC(C)CCC=C(C)C

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.49
ALDH1A1 P00352 1/20 0.45
NFE2L2 Q16236 1/20 0.37
USP2 O75604 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TSHR P16473 1/20 0.32
GGPS1 O95749 2/20 0.31
FDPS P14324 2/20 0.31
EPHX2 P34913 1/20 0.31

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
SCHEMBL9718748 0.80 ALOX15 (0.56) ALOX15ALDH1A1NFE2L2USP2TDP1
SCHEMBL872688 0.74 ALOX15 (0.61) ALOX15ALDH1A1NFE2L2USP2TDP1
SCHEMBL6689625 0.73 ALOX15 (0.60) ALOX15ALDH1A1NFE2L2USP2TSHR
Hydrochloric Acid SCHEMBL6698170 0.72 ALOX15 (0.58) ALOX15ALDH1A1NFE2L2USP2TSHR
SCHEMBL8397532 0.71 ALOX15 (0.67) ALOX15ALDH1A1NFE2L2USP2TDP1
SCHEMBL8059226 0.71 ALOX15 (0.67) ALOX15ALDH1A1NFE2L2USP2TDP1
SCHEMBL873103 0.71 ALOX15 (0.57) ALOX15ALDH1A1NFE2L2USP2TDP1
SCHEMBL9718741 0.71 ALOX15 (0.57) ALOX15ALDH1A1NFE2L2USP2TDP1
SCHEMBL8159094 0.71 ALOX15 (0.57) ALOX15ALDH1A1NFE2L2USP2TDP1
SCHEMBL10410388 0.71 ALOX15 (0.49) ALOX15ALDH1A1NFE2L2USP2TDP1

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
JP-9323998-A None JP disclosed
JP-H09323998-A CITRONELLOL DERIVATIVE, ITS PRODUCTION AND ORGANISM PEST CONTROLLING AGENT FOR AGRICULTURAL AND HORTICULTURAL PURPOSES UBE IND LTD 1997-12-16 JP disclosed