SCHEMBL22017525

SCHEMBL22017525

CC(=O)c1ccc(CCCCCCOc2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.68
L3MBTL1 Q9Y468 2/20 0.65
PLA2G4B P0C869 1/20 0.60
FFAR1 O14842 2/20 0.60
MAOB P27338 1/20 0.56
HSD17B10 Q99714 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
ALDH1A1 P00352 1/20 0.55
HTT P42858 1/20 0.55
MAPT P10636 1/20 0.55
S1PR1 P21453 3/20 0.54
S1PR3 Q99500 1/20 0.54
S1PR5 Q9H228 1/20 0.54
PPARG P37231 1/20 0.52
LMNA P02545 1/20 0.51
KMT2A Q03164 1/20 0.51

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
SCHEMBL11727340 0.92 L3MBTL1 (0.72) GAAL3MBTL1PLA2G4BFFAR1MAOB
SCHEMBL6952535 0.88 L3MBTL1 (0.69) GAAL3MBTL1PLA2G4BFFAR1MAOB
SCHEMBL5282996 0.87 L3MBTL1 (0.85) GAAL3MBTL1MAOBSMN1; SMN2ALDH1A1
SCHEMBL8558008 0.85 LMNA (0.69) MAOBHSD17B10SMN1; SMN2ALDH1A1MAPT
SCHEMBL11741469 0.84 L3MBTL1 (0.79) GAAL3MBTL1PLA2G4BMAOBSMN1; SMN2
SCHEMBL8561241 0.84 LMNA (0.71) MAOBHSD17B10SMN1; SMN2ALDH1A1MAPT
SCHEMBL15981207 0.83 PPARA (0.68) GAAL3MBTL1PLA2G4BFFAR1SMN1; SMN2
SCHEMBL6957386 0.83 MAOB (0.71) GAAL3MBTL1FFAR1MAOBSMN1; SMN2
SCHEMBL5289695 0.82 L3MBTL1 (0.75) GAAL3MBTL1MAOBSMN1; SMN2ALDH1A1
SCHEMBL4366698 0.81 PLA2G4B (0.86) PLA2G4BFFAR1HTTS1PR1S1PR3

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-3653660-A1 THERMALLY CONDUCTIVE MATERIAL, DEVICE PROVIDED WITH THERMALLY CONDUCTIVE LAYER, THERMALLY CONDUCTIVE MATERIAL FORMATION COMPOSITION, DISC-SHAPED LIQUID CRYSTAL COMPOUND FUJIFILM Corporation (JP) 2020-05-20 EP disclosed