SCHEMBL2438560

SCHEMBL2438560

CC(=O)CCCC1(CC=C(C)C)CCCC1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 2/20 0.32
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
ACHE P22303 1/20 0.31
POLB P06746 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL2441272 0.97 PAOX (0.32) PAOXKDM4EATMACHEPOLB
SCHEMBL2446793 0.93 PAOX (0.33) PAOXKDM4EATMACHEPOLB
SCHEMBL2447850 0.78 CYP1A2 (0.34) ALDH1A1
SCHEMBL27832720 0.78 TSHR (0.31)
SCHEMBL14332312 0.77 KDM4E (0.39) PAOXKDM4EATMACHEPOLB
SCHEMBL2440865 0.77 CYP1A2 (0.37) ALDH1A1
SCHEMBL2439262 0.77 SQLE (0.32)
SCHEMBL2437672 0.76
SCHEMBL2440397 0.75
SCHEMBL2440440 0.75 TSHR (0.31)

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-2362765-A2 PERFUME SYSTEMS The Procter & Gamble Company (US) 2011-09-07 EP claimed
WO-2010065446-A2 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY (US) 2010-06-10 WO claimed