SCHEMBL26310718

SCHEMBL26310718

CCCCCCCCC(CCCCCC)C(=O)OCCCCCCCCN(CCCC)CCCCCCCCOC(=O)C(CCCCCC)CCCCCCCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.44
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
CA2 P00918 2/20 0.42
EPHX1 P07099 1/20 0.42
FAAH O00519 1/20 0.41
LMNA P02545 2/20 0.41
CYP1A2 P05177 1/20 0.41
CHRM2 P08172 1/20 0.41
CYP3A4 P08684 1/20 0.41
HTR1A P08908 1/20 0.41
GAA P10253 1/20 0.41
CYP2D6 P10635 1/20 0.41
DRD3 P35462 1/20 0.41
SCN1A P35498 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KCNH2 Q12809 1/20 0.41
SCN2A Q99250 1/20 0.41
SCN3A Q9NY46 1/20 0.41
TSHR P16473 3/20 0.41

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
SCHEMBL25610907 1.00 NAAA (0.44) NAAATHRATHRBCA2EPHX1
SCHEMBL19629038 1.00 NAAA (0.44) NAAATHRATHRBCA2EPHX1
SCHEMBL25610819 1.00 NAAA (0.44) NAAATHRATHRBCA2EPHX1
SCHEMBL25610929 0.98 CA2 (0.45) NAAATHRATHRBCA2EPHX1
SCHEMBL26383988 0.98 CA2 (0.45) NAAATHRATHRBCA2EPHX1
SCHEMBL25610825 0.98 NAAA (0.46) NAAATHRATHRBCA2EPHX1
SCHEMBL25610830 0.98 NAAA (0.46) NAAATHRATHRBCA2EPHX1
SCHEMBL27269261 0.95 NAAA (0.43) NAAATHRATHRBCA2EPHX1
SCHEMBL25989933 0.94 NAAA (0.42) NAAATHRATHRBCA2EPHX1
SCHEMBL27323112 0.94 NAAA (0.42) NAAATHRATHRBCA2EPHX1

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-2023178065-A2 LIPID COMPOUNDS AND LIPID NANOPARTICLES BROADPHARM INC. (US) 2023-09-21 WO disclosed