SCHEMBL16128908

SCHEMBL16128908

C=C(/C=C\C=C/C)NCC

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.33
CNR1 P21554 4/20 0.33
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33

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
SCHEMBL20226873 0.83
SCHEMBL22074762 0.83
SCHEMBL24377548 0.83 CNR2 (0.32) CNR2CNR1PPARGPPARDPPARA
SCHEMBL22857395 0.79
SCHEMBL24464904 0.78
SCHEMBL19176312 0.77 CNR2 (0.31) CNR2CNR1PPARGPPARDPPARA
SCHEMBL14102114 0.76
SCHEMBL14365531 0.75 CNR2 (0.37) CNR2CNR1PPARGPPARDPPARA
SCHEMBL24780616 0.74 ALDH1A1 (0.31)
SCHEMBL16509994 0.74

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-2014153145-A2 CRYSTALS OF LAQUINIMOD SODIUM AND IMPROVED PROCESS FOR THE MANUFACTURE THEREOF TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2014-09-25 WO disclosed