SCHEMBL8919451

SCHEMBL8919451

CC(C)OC(C/C=C\CCCC(C)OCc1ccccc1)OC(C)C

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RCE1 Q9Y256 1/20 0.42
HTT P42858 4/20 0.35
MAPT P10636 2/20 0.34
TOP1 P11387 1/20 0.32
IDO1 P14902 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
FAAH O00519 1/20 0.30
AGXT P21549 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
SCHEMBL8919453 1.00 RCE1 (0.42) RCE1HTTMAPTTOP1IDO1
SCHEMBL8917997 0.76 SLC1A3 (0.41) RCE1HTTMAPTALDH1A1LMNA
SCHEMBL8916935 0.75 TOP1 (0.56) MAPTTOP1ALDH1A1LMNAHPGD
SCHEMBL8916038 0.75 FAAH (0.35) RCE1ALDH1A1FAAH
SCHEMBL6679829 0.72 CTSK (0.43) MAPTALDH1A1TSHRMAPK1
SCHEMBL8918136 0.71 RCE1 (0.47) RCE1HTTMAPTIDO1TSHR
SCHEMBL4443355 0.71 FAAH (0.40) RCE1HTTMAPTALDH1A1LMNA
SCHEMBL4443362 0.71 FAAH (0.40) RCE1HTTMAPTALDH1A1LMNA
SCHEMBL6683665 0.70 ALDH1A1 (0.47) ALDH1A1TSHRMAPK1
SCHEMBL2300063 0.70 LTA4H (0.44) RCE1HTTMAPTALDH1A1LMNA

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-5656260-A CONSISTS OF (3Z,,6Z)DODECADIENE-12-OLIDE AND 13-METHYL-(3Z,5Z)-13-OLIDE TOGETHER WITH FUNGAL VOLATILE SELECTED FROM 1-OCTEN-3-OL, 3-OCTANOL, 3-METHYLBUTANOL; EFFECTIVE TRAP FOR OKRYZAEPHILUS SURINAMENSIS BETTLE THE MINISTER OF AGRICULTURE FISHERIES AND FOOD IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE U.K. OF GT. BRITAIN AND N. IRELAND (GB) 1997-08-12 US disclosed