SCHEMBL4783456

SCHEMBL4783456

CCCCCCC(O)CCCCCCCCCCC(=O)c1cccc2[nH]nnc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.42
FFAR1 O14842 1/20 0.42
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
PTGER1 P34995 1/20 0.39
PTGER4 P35408 1/20 0.39
PTGER3 P43115 1/20 0.39
PTPN2 P17706 2/20 0.38
PTPN1 P18031 2/20 0.38
CDC25B P30305 2/20 0.38
PTPN6 P29350 1/20 0.38
PTPN11 Q06124 1/20 0.38
GPR84 Q9NQS5 1/20 0.37
DAGLA Q9Y4D2 1/20 0.37
OXER1 Q8TDS5 1/20 0.37
FAAH O00519 2/20 0.36

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
SCHEMBL28472895 0.92 HTT (0.46) MEN1ALDH1A1MAPTHTTKMT2A
SCHEMBL27499079 0.85 DAGLA (0.53) DAGLAFAAH
SCHEMBL27500608 0.83 DAGLA (0.51) FFAR4FFAR1ALDH1A1DAGLAOXER1
SCHEMBL27517110 0.80 DAGLA (0.47) MEN1ALDH1A1MAPTKMT2ADAGLA
SCHEMBL11137879 0.79 CTNNB1 (0.33) MEN1ALDH1A1MAPTHTTKMT2A
SCHEMBL9491496 0.77 SPHK2 (0.34) MEN1ALDH1A1MAPTHTTKMT2A
SCHEMBL6141204 0.77 RIPK1 (0.34) ALDH1A1PTPN2PTPN1CDC25BPTPN6
SCHEMBL6141547 0.76 PARP1 (0.35) ALDH1A1LTB4R
SCHEMBL6140866 0.76 DNM1 (0.35) ALDH1A1LTB4R
SCHEMBL4066807 0.76 HTT (0.46) FFAR1MEN1ALDH1A1MAPTHTT

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
WO-2008037288-A1 SACCHARIDE ESTERS AND THEIR USE AS SURFACTANT TIENSE SUIKERRAFINADERIJ NV. (BE) 2008-04-03 WO claimed
WO-2008037288-A1 SACCHARIDE ESTERS AND THEIR USE AS SURFACTANT TIENSE SUIKERRAFINADERIJ NV. (BE) 2008-04-03 WO disclosed