SCHEMBL9634677

SCHEMBL9634677

CCCCCCCCC(O)CC(F)F

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.50
FFAR1 O14842 2/20 0.48
FFAR4 Q5NUL3 1/20 0.48
MAPT P10636 1/20 0.47
SPHK1 Q9NYA1 2/20 0.43
PSMD14 O00487 2/20 0.43
PLA2G1B P04054 2/20 0.43
MMP2 P08253 2/20 0.43
ATG4B Q9Y4P1 2/20 0.43
LMNA P02545 2/20 0.43
HSP90AA1 P07900 1/20 0.43
RAD52 P43351 1/20 0.43
NFKB1 P19838 1/20 0.42
GMNN O75496 1/20 0.41
POLB P06746 1/20 0.41
CYP2D6 P10635 1/20 0.41
THPO P40225 1/20 0.41
MTOR P42345 1/20 0.41
BLM P54132 1/20 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
SCHEMBL14830405 0.96 GPR84 (0.47) GPR84FFAR1FFAR4MAPTSPHK1
SCHEMBL30787442 0.85 GPR84 (0.58) GPR84FFAR1FFAR4MAPTSPHK1
SCHEMBL30787387 0.85 GPR84 (0.58) GPR84FFAR1FFAR4MAPTSPHK1
SCHEMBL30787133 0.85 GPR84 (0.58) GPR84FFAR1FFAR4MAPTSPHK1
SCHEMBL23092219 0.85 GPR84 (0.58) GPR84FFAR1FFAR4MAPTSPHK1
SCHEMBL23092220 0.85 GPR84 (0.58) GPR84FFAR1FFAR4MAPTSPHK1
SCHEMBL11200396 0.85 GPR84 (0.58) GPR84FFAR1FFAR4MAPTSPHK1
SCHEMBL3356583 0.85 GPR84 (0.58) GPR84FFAR1FFAR4MAPTSPHK1
SCHEMBL30787224 0.85 GPR84 (0.58) GPR84FFAR1FFAR4MAPTSPHK1
SCHEMBL12079735 0.85 GPR84 (0.58) GPR84FFAR1FFAR4MAPTSPHK1

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
US-5096613-A OPTICALLY ACTIVE FLUORINE-CONTAINING ALCOHOL COMPOUNDS AND LIQUID CRYSTAL COMPOUNDS THEREFROM SHOWA SHELL SEKIYU KABUSHIKI KAISHA (JP) 1992-03-17 US disclosed