SCHEMBL18697251

SCHEMBL18697251

CCCCCCCCCCCCCCCCC(=O)OCCN1CCOCC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.57
THRB P10828 8/20 0.55
THRA P10827 2/20 0.55
ALDH1A1 P00352 4/20 0.53
TLR2 O60603 1/20 0.52
LMNA P02545 2/20 0.51
MAPT P10636 1/20 0.51
KMT2A Q03164 1/20 0.51
MAPK1 P28482 2/20 0.49
CYP1A2 P05177 1/20 0.49
CHRM2 P08172 1/20 0.49
CHRM1 P11229 1/20 0.49
HTR2A P28223 1/20 0.49
SCN1A P35498 1/20 0.49
HTR2B P41595 1/20 0.49
KCNH2 Q12809 1/20 0.49
SCN2A Q99250 1/20 0.49
SIGMAR1 Q99720 1/20 0.49
SCN3A Q9NY46 1/20 0.49
HRH3 Q9Y5N1 1/20 0.49

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
SCHEMBL20465870 1.00 DGKA (0.57) DGKATHRBTHRAALDH1A1TLR2
SCHEMBL143985 1.00 DGKA (0.57) DGKATHRBTHRAALDH1A1TLR2
SCHEMBL12120360 1.00 DGKA (0.57) DGKATHRBTHRAALDH1A1TLR2
SCHEMBL501472 1.00 DGKA (0.57) DGKATHRBTHRAALDH1A1TLR2
SCHEMBL14505693 1.00 DGKA (0.57) DGKATHRBTHRAALDH1A1TLR2
SCHEMBL142816 1.00 DGKA (0.57) DGKATHRBTHRAALDH1A1TLR2
SCHEMBL145889 1.00 DGKA (0.57) DGKATHRBTHRAALDH1A1TLR2
SCHEMBL145675 1.00 DGKA (0.57) DGKATHRBTHRAALDH1A1TLR2
SCHEMBL22451880 1.00 DGKA (0.57) DGKATHRBTHRAALDH1A1TLR2
SCHEMBL143263 1.00 DGKA (0.57) DGKATHRBTHRAALDH1A1TLR2

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-3032332-B1 SHRINK MATERIAL AND PATTERN FORMING PROCESS SHINETSU CHEMICAL CO (JP) 2017-04-05 EP disclosed