SCHEMBL12581828

SCHEMBL12581828

CNCCOP(=O)(O)OCC(C)OCCCCC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.37
▸ P2RY10 O00398 8/20 0.36
▸ GPR34 Q9UPC5 3/20 0.36
▸ PLA2G2C Q5R387 2/20 0.34
▸ PLA2G2A P14555 2/20 0.33

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
SCHEMBL13352018 0.99 ALDH1A1 (0.40) ALDH1A1P2RY10GPR34PLA2G2CPLA2G2A
SCHEMBL12348908 0.83 LPAR1 (0.51) P2RY10GPR34PLA2G2C
SCHEMBL2602822 0.82 FABP3 (0.48) ALDH1A1P2RY10GPR34
SCHEMBL12349096 0.80 LPAR1 (0.57) P2RY10GPR34PLA2G2C
SCHEMBL13352075 0.80 LPAR1 (0.57) P2RY10GPR34PLA2G2C
SCHEMBL12349100 0.78 LPAR1 (0.57) P2RY10PLA2G2CPLA2G2A
SCHEMBL12348984 0.76 P2RY10 (0.53) P2RY10GPR34PLA2G2C
SCHEMBL19354801 0.70 LPAR1 (0.44) ALDH1A1P2RY10GPR34PLA2G2C
SCHEMBL15942985 0.70 LPAR1 (0.44) ALDH1A1P2RY10GPR34PLA2G2C
SCHEMBL19354790 0.69 LPAR1 (0.46) ALDH1A1P2RY10GPR34PLA2G2C

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
WO-2010052718-A9 OXIDIZED LIPID COMPOUNDS AND USES THEREOF VASCULAR BIOGENICS LTD. (IL) 2011-06-16 — — WO disclosed
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