SCHEMBL10693617

SCHEMBL10693617

CCCCCCCCCCCC(=O)OC(C(=O)NCC)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ASAH1 Q13510 2/20 0.50
NAAA Q02083 2/20 0.49
TLR2 O60603 5/20 0.48
KLK7 P49862 1/20 0.47
ALDH1A1 P00352 1/20 0.46
ACER2 Q5QJU3 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
LMNA P02545 2/20 0.45
EPHX2 P34913 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PKM P14618 1/20 0.44
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 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
SCHEMBL23397628 0.85 LMNA (0.51) ASAH1NAAATLR2ALDH1A1ACER2
SCHEMBL18206788 0.85 LMNA (0.51) ASAH1NAAATLR2ALDH1A1ACER2
SCHEMBL10694432 0.82 LMNA (0.49) ASAH1NAAATLR2ALDH1A1ACER2
SCHEMBL19107048 0.80 LMNA (0.46) ASAH1TLR2ALDH1A1ACER2LMNA
SCHEMBL10694396 0.80 KLK7 (0.60) KLK7PKM
SCHEMBL4214175 0.79 LMNA (0.54) ASAH1NAAATLR2ALDH1A1ACER2
SCHEMBL966243 0.79 LMNA (0.54) ASAH1NAAATLR2ALDH1A1ACER2
SCHEMBL966036 0.79 LMNA (0.54) ASAH1NAAATLR2ALDH1A1ACER2
SCHEMBL964635 0.79 LMNA (0.54) ASAH1NAAATLR2ALDH1A1ACER2
SCHEMBL4208878 0.79 LMNA (0.54) ASAH1NAAATLR2ALDH1A1ACER2

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
EP-0098743-B1 PHENYL ALPHA-ACYLOXYACETAMIDE DERIVATES AND THEIR THERAPEUTIC USE Yu, Ruey J., Dr. (US) 1988-09-28 EP claimed