SCHEMBL15906508

SCHEMBL15906508

C#CC(c1ccc(OCCC)cc1)c1ccc(OCCC)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.46
ACACB O00763 8/20 0.46
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
GPR88 Q9GZN0 1/20 0.42
SLC2A1 P11166 2/20 0.41
ACACA Q13085 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PLK1 P53350 1/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL19139906 0.85 NQO1 (0.56) LTA4HACACBCA12CA1CA2
SCHEMBL7202465 0.82 LTA4H (0.47) LTA4HACACBMEN1KMT2AGPR88
SCHEMBL15906526 0.82 MAPT (0.48) ACACBL3MBTL1NPC1ALDH1A1MAPT
SCHEMBL2492281 0.78 LTA4H (0.53) LTA4HACACBCA12CA1CA2
SCHEMBL8376489 0.78 FFAR1 (0.35) ACACBALDH1A1
1,4-Dipropoxybenzene SCHEMBL122039 0.77 LTA4H (0.67) LTA4HCA12CA1CA2CA7
SCHEMBL163688 0.76 LTA4H (0.52) LTA4HACACBCA12CA1CA2
SCHEMBL6473012 0.76 MEN1 (0.54) LTA4HACACBCA12CA1CA2
SCHEMBL6336026 0.76 PSMB1 (0.54) LTA4HACACBCA12CA1CA2
SCHEMBL15010950 0.75 LTA4H (0.47) LTA4HSLC2A1SMN1; SMN2

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-2759543-A1 CHROMENE COMPOUND AND CURABLE COMPOSITION Tokuyama Corporation (JP) 2014-07-30 EP disclosed