SCHEMBL2879443

SCHEMBL2879443

CCCCCC=CCC=CC/C=C\C/C=C\CCCCOCC(CN1CCCC1)OCCCCCCCC/C=C\C/C=C\CCCCC

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.53
CNR1 P21554 1/20 0.53
CNR2 P34972 1/20 0.53
LPAR1 Q92633 2/20 0.43
LPAR3 Q9UBY5 2/20 0.43

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
SCHEMBL3490523 1.00 ALDH1A1 (0.53) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL2840970 1.00 ALDH1A1 (0.53) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL2840040 1.00 ALDH1A1 (0.53) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL3488076 1.00 ALDH1A1 (0.53) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL2841053 1.00 ALDH1A1 (0.53) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL3490529 1.00 ALDH1A1 (0.53) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL3238670 1.00 ALDH1A1 (0.53) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL19617734 1.00 ALDH1A1 (0.53) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL16371200 1.00 ALDH1A1 (0.53) ALDH1A1CNR1CNR2LPAR1LPAR3
SCHEMBL3487909 1.00 ALDH1A1 (0.53) ALDH1A1CNR1CNR2LPAR1LPAR3

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
WO-2010030730-A1 POLYETHYLENE GLYCOL LIPID CONJUGATES AND USES THEREOF ABBOTT LABORATORIES (US) 2010-03-18 WO claimed
WO-2010030730-A1 POLYETHYLENE GLYCOL LIPID CONJUGATES AND USES THEREOF ABBOTT LABORATORIES (US) 2010-03-18 WO disclosed