SCHEMBL5959944

SCHEMBL5959944

CCCOP(=O)(O)OCC(COC(C)=O)OC(=O)CC

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.51
LPAR3 Q9UBY5 7/20 0.47
LPAR1 Q92633 4/20 0.47
ENPP2 Q13822 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
SMPD1 P17405 1/20 0.41
LPAR2 Q9HBW0 2/20 0.41
SELP P16109 1/20 0.40
PLCG2 P16885 1/20 0.39
MAPT P10636 1/20 0.38
P2RY10 O00398 3/20 0.38
GPR34 Q9UPC5 1/20 0.38
PLA2G2C Q5R387 1/20 0.38

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
SCHEMBL26468965 0.92 FABP3 (0.56) FABP3LPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL17084575 0.90 FABP3 (0.48) FABP3LPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL13410045 0.81 FABP3 (0.51) FABP3LPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL14947024 0.81 FABP3 (0.51) FABP3LPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL2607968 0.81 FABP3 (0.51) FABP3LPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL23219279 0.80 PGD (0.45) FABP3LPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL15695764 0.80 ALDH1A1 (0.47) LPAR3LPAR1ENPP2SMN1; SMN2LPAR2
SCHEMBL23219297 0.80 LPAR3 (0.58) FABP3LPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL15385423 0.79 FABP3 (0.64) FABP3LPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL22982784 0.78 FABP3 (0.71) FABP3LPAR3LPAR1ENPP2SMN1; SMN2

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-8178713-B2 Sulfur-containing phospholipid derivatives Pronovo Biopharma Norge AS (NO) 2012-05-15 US disclosed