SCHEMBL18957516

SCHEMBL18957516

CCCCCCCCCCC(=O)OCCCC1CO1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.61
ALDH1A1 P00352 1/20 0.55
DNM1 Q05193 1/20 0.51
PRSS1 P07477 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
PRKCA P17252 2/20 0.48
PAM P19021 2/20 0.47
NAAA Q02083 1/20 0.47
EPHX2 P34913 1/20 0.47
HTR2C P28335 1/20 0.46

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
SCHEMBL18957526 0.98 DGKA (0.59) DGKAALDH1A1DNM1PRSS1PRSS2
SCHEMBL467560 0.95 DGKA (0.59) DGKAALDH1A1DNM1PRSS1PRSS2
SCHEMBL18957507 0.95 DGKA (0.59) DGKAALDH1A1DNM1PRSS1PRSS2
SCHEMBL4597676 0.95 DGKA (0.59) DGKAALDH1A1DNM1PRSS1PRSS2
SCHEMBL20500772 0.95 DGKA (0.59) DGKAALDH1A1DNM1PRSS1PRSS2
SCHEMBL18957525 0.92 DGKA (0.54) DGKAALDH1A1DNM1PRSS1PRSS2
SCHEMBL10309225 0.92 DGKA (0.53) DGKAALDH1A1DNM1PRSS1PRSS2
SCHEMBL467658 0.92 DGKA (0.62) DGKAALDH1A1DNM1PAM
SCHEMBL11909958 0.89 DGKA (0.51) DGKAALDH1A1DNM1PRSS1PRSS2
SCHEMBL11909330 0.89 DGKA (0.51) DGKAALDH1A1DNM1PRSS1PRSS2

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-2017100744-A1 AMINOLIPIDOIDS AND USES THEREOF Preceres Inc. (US) 2017-06-15 WO disclosed