SCHEMBL6880890

SCHEMBL6880890

CC(C)=CCCC(C)CC/C(C)=C(/C)C(=O)ON

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.50
ALDH1A1 P00352 2/20 0.46
USP2 O75604 1/20 0.40
TSHR P16473 1/20 0.36
NFE2L2 Q16236 1/20 0.35
GGPS1 O95749 2/20 0.34
FDPS P14324 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
EPHX2 P34913 1/20 0.33
POLB P06746 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
SCHEMBL1797117 0.81 ALOX15 (0.52) ALOX15ALDH1A1USP2TSHRGGPS1
SCHEMBL907663 0.81 ALOX15 (0.52) ALOX15ALDH1A1USP2TSHRGGPS1
SCHEMBL16977250 0.75 ALOX15 (0.61) ALOX15ALDH1A1USP2TSHRGGPS1
SCHEMBL9451976 0.73 ALOX15 (0.59) ALOX15ALDH1A1USP2TSHR
SCHEMBL1472117 0.72 ALOX15 (0.57) ALOX15ALDH1A1USP2TSHRGGPS1
SCHEMBL9578859 0.72 ALOX15 (0.57) ALOX15ALDH1A1USP2TSHRGGPS1
SCHEMBL3923778 0.71 ALOX15 (0.51) ALOX15ALDH1A1USP2TSHRNFE2L2
SCHEMBL3161396 0.70 ALOX15 (0.65) ALOX15ALDH1A1USP2TSHRNFE2L2
SCHEMBL3085621 0.70 ALOX15 (0.55) ALOX15ALDH1A1USP2TSHRGGPS1
SCHEMBL11209467 0.70 ALOX15 (0.55) ALOX15ALDH1A1USP2TSHRGGPS1

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
US-20040202689-A1 Terpenoid fragrance components stabilized with malonic acid salts UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2004-10-14 US disclosed