SCHEMBL6250127

SCHEMBL6250127

CC(C)=CCCC(C)CC1OC=CO1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.48
ALDH1A1 P00352 1/20 0.48
NFE2L2 Q16236 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
TSHR P16473 2/20 0.37
USP2 O75604 1/20 0.35
GLA P06280 1/20 0.35
SRC P12931 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GGPS1 O95749 2/20 0.32
FDPS P14324 2/20 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
SCHEMBL6250124 1.00 ALOX15 (0.48) ALOX15ALDH1A1NFE2L2TDP1TSHR
SCHEMBL6253545 1.00 ALOX15 (0.48) ALOX15ALDH1A1NFE2L2TDP1TSHR
SCHEMBL27967930 0.83 ALOX15 (0.53) ALOX15ALDH1A1NFE2L2TDP1TSHR
SCHEMBL14548161 0.80 ALOX15 (0.50) ALOX15ALDH1A1NFE2L2TDP1TSHR
SCHEMBL15457612 0.80 ALOX15 (0.50) ALOX15ALDH1A1NFE2L2TDP1TSHR
SCHEMBL6251037 0.80 ALOX15 (0.50) ALOX15ALDH1A1NFE2L2TDP1TSHR
SCHEMBL6254141 0.79 ALOX15 (0.46) ALOX15ALDH1A1NFE2L2TDP1TSHR
SCHEMBL6252281 0.79 ALOX15 (0.46) ALOX15ALDH1A1NFE2L2TDP1TSHR
SCHEMBL6252287 0.79 ALOX15 (0.46) ALOX15ALDH1A1NFE2L2TDP1TSHR
SCHEMBL3759620 0.76 ALOX15 (0.50) ALOX15ALDH1A1NFE2L2TDP1TSHR

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
EP-1567013-A1 ACETALS AS INSECT REPELLANT AGENTS Bencsits, Franz (AT) 2005-08-31 EP claimed
WO-2004039158-A1 ACETALS AS INSECT REPELLANT AGENTS BENCSITS FRANZ (AT) 2004-05-13 WO claimed