SCHEMBL19865286

SCHEMBL19865286

O=C1c2c(-c3cccs3)ccc(Oc3cc(F)cc(F)c3)c2OC1(F)F

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ VEGFA P15692 6/20 0.33
▸ GABRA1 P14867 1/20 0.32
▸ GABRG2 P18507 1/20 0.32
▸ GABRB3 P28472 1/20 0.32
▸ GABRA5 P31644 1/20 0.32
▸ GABRA3 P34903 1/20 0.32
▸ GABRA2 P47869 1/20 0.32
▸ MAOB P27338 3/20 0.31
▸ ERN1 O75460 1/20 0.31
▸ LTK P29376 1/20 0.31
▸ CDK5 Q00535 1/20 0.31
▸ MST1R Q04912 1/20 0.31
▸ DYRK1A Q13627 1/20 0.31
▸ CLK4 Q9HAZ1 1/20 0.31
▸ TMIGD3 P0DMS9 1/20 0.31
▸ MAPT P10636 1/20 0.30
▸ MIF P14174 1/20 0.30
▸ EPAS1 Q99814 1/20 0.30

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
SCHEMBL19865287 0.75 VEGFA (0.41) VEGFAEPAS1
SCHEMBL19865213 0.75 VEGFA (0.45) VEGFAEPAS1
SCHEMBL19865445 0.73 EPAS1 (0.49) VEGFAEPAS1
SCHEMBL19865466 0.71 EPAS1 (0.52) VEGFAEPAS1
SCHEMBL19865328 0.70 EPAS1 (0.51) VEGFAEPAS1
SCHEMBL19865284 0.69 ERN1 (0.41) VEGFAERN1TMIGD3MAPTEPAS1
SCHEMBL19865245 0.66 VEGFA (0.54) VEGFAEPAS1
SCHEMBL19865314 0.65 EPAS1 (0.51) VEGFAEPAS1
SCHEMBL19865425 0.65 EPAS1 (0.65) VEGFAEPAS1
SCHEMBL19865283 0.64 ERN1 (0.43) ERN1MAPT

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-2018031680-A1 NOVEL COMPOUNDS, USES AND METHODS FOR THEIR PREPARATION FRONTHERA U.S. PHARMACEUTICALS LLC (US) 2018-02-15 — — WO disclosed
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