SCHEMBL7217637

SCHEMBL7217637

CCCCCCC(C)OC(=O)C(CC)CCC

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.59
CNR1 P21554 1/20 0.50
CNR2 P34972 1/20 0.50
CA2 P00918 2/20 0.49
CA1 P00915 1/20 0.49
ALDH1A1 P00352 1/20 0.46
ZDHHC7 Q9NXF8 1/20 0.42
NAAA Q02083 1/20 0.42
LMNA P02545 2/20 0.41
ABCB1 P08183 1/20 0.40
KDM4E B2RXH2 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL7217342 0.95 FAAH (0.61) FAAHCNR1CNR2CA2CA1
SCHEMBL246299 0.93 FAAH (0.59) FAAHCNR1CNR2CA2CA1
SCHEMBL27803012 0.93 FAAH (0.59) FAAHCNR1CNR2CA2CA1
SCHEMBL7223074 0.93 FAAH (0.59) FAAHCNR1CNR2CA2CA1
SCHEMBL1377605 0.93 FAAH (0.59) FAAHCNR1CNR2CA2CA1
SCHEMBL7218998 0.93 FAAH (0.63) FAAHCNR1CNR2CA2ALDH1A1
SCHEMBL7219236 0.93 FAAH (0.63) FAAHCNR1CNR2CA2CA1
SCHEMBL22844536 0.93 FAAH (0.63) FAAHCNR1CNR2CA2CA1
SCHEMBL27781446 0.90 FAAH (0.59) FAAHCNR1CNR2CA2CA1
SCHEMBL7217611 0.88 CA2 (0.55) FAAHCNR1CNR2CA2CA1

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
US-6667285-B1 Branched-chain carboxylic acid monoalkyl ester with outstanding hydrolytic stability NEW JAPAN CHEMICAL CO., LTD. (JP) 2003-12-23 US disclosed
EP-1225213-A1 LUBRICATING OIL FOR REFRIGERATOR, HYDRAULIC FLUID COMPOSITION FOR REFRIGERATOR AND METHOD FOR LUBRICATION OF REFRIGERATOR NEW JAPAN CHEMICAL CO.,LTD. (JP) 2002-07-24 EP disclosed