SCHEMBL11510461

SCHEMBL11510461

CCOC(=O)C(C)Oc1ccc(COc2ccc(Cl)cc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.76
LMNA P02545 1/20 0.76
EPHX2 P34913 2/20 0.62
MAOB P27338 6/20 0.56
MAOA P21397 3/20 0.56
FFAR1 O14842 1/20 0.54
NR4A2 P43354 1/20 0.54
KMT2A Q03164 1/20 0.51
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
APP P05067 1/20 0.48
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47

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
SCHEMBL23605759 1.00 L3MBTL1 (0.76) L3MBTL1LMNAEPHX2MAOBMAOA
SCHEMBL11512616 0.92 LMNA (0.63) L3MBTL1LMNAEPHX2MAOBMAOA
SCHEMBL11511110 0.90 L3MBTL1 (0.61) L3MBTL1LMNAEPHX2MAOBMAOA
SCHEMBL5204883 0.89 EPHX2 (0.66) L3MBTL1LMNAEPHX2KMT2A
SCHEMBL10022852 0.89 EPHX2 (0.66) L3MBTL1LMNAEPHX2KMT2A
SCHEMBL11510744 0.88 L3MBTL1 (0.60) L3MBTL1LMNAEPHX2MAOBMAOA
SCHEMBL11510411 0.88 LMNA (0.59) L3MBTL1LMNAEPHX2MAOBMAOA
SCHEMBL11514842 0.88 LMNA (0.59) L3MBTL1LMNAEPHX2MAOBMAOA
SCHEMBL21991255 0.88 L3MBTL1 (0.58) L3MBTL1LMNAEPHX2MAOBMAOA
SCHEMBL10344790 0.88 L3MBTL1 (0.58) L3MBTL1LMNAEPHX2MAOBMAOA

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-4169720-A 2-[4-(4-Chlorophenoxymethyl)-phenoxy]-propionic acid compounds as herbicides CELAMERCK GMBH & CO. KG (DE) 1979-10-02 US disclosed