SCHEMBL8722724

SCHEMBL8722724

CCCCCCCCCCOc1ccc2c(ccc3nc(OCCCCCCC)ccc32)c1F

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.39
NCF1 P14598 1/20 0.37
MCHR1 Q99705 2/20 0.36
MAPT P10636 1/20 0.36
SOAT1 P35610 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
PLA2G2D Q9UNK4 1/20 0.35
S1PR3 Q99500 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
PTPN11 Q06124 1/20 0.34

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
SCHEMBL8722600 1.00 TLR8 (0.39) TLR8NCF1MCHR1MAPTSOAT1
SCHEMBL8720299 1.00 TLR8 (0.39) TLR8NCF1MCHR1MAPTSOAT1
SCHEMBL8720136 1.00 TLR8 (0.39) TLR8NCF1MCHR1MAPTSOAT1
SCHEMBL8724265 1.00 TLR8 (0.39) TLR8NCF1MCHR1MAPTSOAT1
SCHEMBL8905326 1.00 TLR8 (0.39) TLR8NCF1MCHR1MAPTSOAT1
SCHEMBL8723136 1.00 TLR8 (0.39) TLR8NCF1MCHR1MAPTSOAT1
SCHEMBL8719419 1.00 TLR8 (0.39) TLR8NCF1MCHR1MAPTSOAT1
SCHEMBL8720125 1.00 TLR8 (0.39) TLR8NCF1MCHR1MAPTSOAT1
SCHEMBL8720141 1.00 TLR8 (0.39) TLR8NCF1MCHR1MAPTSOAT1
SCHEMBL8720493 1.00 TLR8 (0.39) TLR8NCF1MCHR1MAPTSOAT1

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-0839173-A1 FERROELECTRIC LIQUID CRYSTAL MIXTURE Hoechst Research & Technology Deutschland GmbH & Co. KG (DE) 1998-05-06 EP disclosed