SCHEMBL3625302

SCHEMBL3625302

CCCCC(=O)ON=C=O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.42
CA1 P00915 1/20 0.41
CES1 P23141 3/20 0.41
CES2 O00748 2/20 0.41
DGKA P23743 1/20 0.41
LMNA P02545 2/20 0.38
ALDH1A1 P00352 3/20 0.38
TP53 P04637 1/20 0.38
PAM P19021 2/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
MAPT P10636 2/20 0.36
MAPK1 P28482 1/20 0.36
TSHR P16473 1/20 0.35

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
SCHEMBL1162519 0.94 DGKA (0.48) CES1CES2DGKALMNAALDH1A1
SCHEMBL27750348 0.92 DGKA (0.52) CES1CES2DGKALMNAALDH1A1
SCHEMBL27771196 0.92 DGKA (0.52) CES1CES2DGKALMNAALDH1A1
SCHEMBL28242516 0.90 DGKA (0.50) CES1CES2DGKALMNAALDH1A1
SCHEMBL1602613 0.87
SCHEMBL9063932 0.87 TSHR (0.35) DGKALMNAPRSS1PRSS2PRSS3
SCHEMBL28442796 0.83 FAAH (0.57) LMNATP53MAPT
SCHEMBL21315579 0.78
SCHEMBL10699573 0.78 TSHR (0.48) LMNAALDH1A1MAPTTSHR
SCHEMBL27320768 0.76

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-7829209-B2 Solid polymer electrolyte for fuel cell and fuel cell containing the same SAMSUNG SDI CO., LTD. (KR) 2010-11-09 US disclosed
US-20060089441-A1 Solid polymer electrolyte for fuel cell and fuel cell containing the same SAMSUNG SDI CO., LTD. 2006-04-27 US disclosed