SCHEMBL2441272

SCHEMBL2441272

CC(=O)CCCC1(CC=C(C)C)CCC1

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
SCHEMBL2438560 0.97 PAOX (0.32) PAOXKDM4EATMACHEPOLB
SCHEMBL2446793 0.93 PAOX (0.33) PAOXKDM4EATMACHEPOLB
SCHEMBL2439262 0.80 SQLE (0.32)
SCHEMBL2498544 0.78 CYP1A2 (0.31) ALDH1A1
SCHEMBL2440440 0.78 TSHR (0.31)
SCHEMBL14332312 0.77 KDM4E (0.39) PAOXKDM4EATMACHEPOLB
SCHEMBL1697976 0.76
SCHEMBL2499890 0.75
SCHEMBL1697992 0.75 ALOX15 (0.39) ALDH1A1
SCHEMBL27832720 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