SCHEMBL10496142

SCHEMBL10496142

CCOC(=O)C(C)Oc1ccc(OCc2ccccc2)c(F)c1

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.71
L3MBTL1 Q9Y468 1/20 0.71
FFAR1 O14842 15/20 0.49
PPARD Q03181 9/20 0.49
MRGPRX4 Q96LA9 2/20 0.48
S1PR5 Q9H228 1/20 0.45

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
SCHEMBL10496157 0.92 LMNA (0.70) LMNAL3MBTL1FFAR1PPARDMRGPRX4
SCHEMBL9469655 0.83 LMNA (1.00) LMNAL3MBTL1PPARD
SCHEMBL9367416 0.83 LMNA (1.00) LMNAL3MBTL1PPARD
SCHEMBL9621415 0.83 LMNA (1.00) LMNAL3MBTL1PPARD
SCHEMBL13248965 0.82 S1PR5 (0.51) LMNAL3MBTL1FFAR1PPARDMRGPRX4
SCHEMBL27517363 0.82 LMNA (0.72) LMNAL3MBTL1FFAR1
SCHEMBL28165602 0.81 L3MBTL1 (0.80) LMNAL3MBTL1
SCHEMBL1128493 0.79 FFAR1 (0.59) FFAR1PPARDMRGPRX4
SCHEMBL12635054 0.78 L3MBTL1 (0.70) LMNAL3MBTL1
SCHEMBL27406673 0.78 LMNA (0.77) LMNAL3MBTL1FFAR1MRGPRX4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4803273-A HERBICIDES ICI AUSTRALIA LIMITED (AU) 1989-02-07 US disclosed
US-4655819-A Quinoxalinyloxy phenoxy proprionic acid derivatives as selective herbicides ICI AUSTRALIA LIMITED (AU) 1987-04-07 US disclosed
EP-0060607-B1 2-(2-HALO-4-(6-HALOQUINOXALIN-2-YLOXY)PHENOXY)PROPIONATES, PROCESS FOR THEIR SYNTHESIS, HERBICIDAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS HERBICIDES ICI AUSTRALIA LIMITED (AU) 1985-08-28 EP disclosed
EP-0060607-A1 2-(2-halo-4-(6-haloquinoxalin-2-yloxy)phenoxy)propionates, process for their synthesis, herbicidal compositions containing them and their use as herbicides ICI AUSTRALIA LIMITED (AU) 1982-09-22 EP disclosed