SCHEMBL9206341

SCHEMBL9206341

CCOC(=O)C(Cc1ccc(F)cc1)(Oc1ccccc1OCC)C(=O)OCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.48
MEN1 O00255 2/20 0.48
GAA P10253 2/20 0.48
L3MBTL1 Q9Y468 5/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MAPK1 P28482 2/20 0.42
GLA P06280 1/20 0.42
LMNA P02545 4/20 0.42
ALDH1A1 P00352 4/20 0.41
RECQL P46063 1/20 0.41
MMP8 P22894 1/20 0.41
PKM P14618 1/20 0.41
MAPT P10636 4/20 0.40
HPGD P15428 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALOX12 P18054 1/20 0.40

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
SCHEMBL7860078 0.85 ALDH1A1 (0.47) KMT2AL3MBTL1GLAALDH1A1RECQL
SCHEMBL7861235 0.83 ALDH1A1 (0.48) L3MBTL1TDP1MAPK1LMNAALDH1A1
SCHEMBL9641284 0.77 KMT2A (0.41) KMT2AMEN1GAAL3MBTL1CYP1A2
SCHEMBL9199837 0.77 ALDH1A1 (0.47) L3MBTL1TDP1LMNAALDH1A1RECQL
SCHEMBL9209376 0.77 L3MBTL1 (0.40) KMT2AMEN1L3MBTL1CYP1A2CYP2C19
SCHEMBL3102952 0.74 MAPT (0.49) KMT2AMEN1GAAL3MBTL1CYP1A2
SCHEMBL11285420 0.74 MAPT (0.46) KMT2AMEN1GAAL3MBTL1CYP1A2
SCHEMBL28753087 0.73 MMP8 (0.57) KMT2AMEN1GAAL3MBTL1CYP1A2
SCHEMBL29277093 0.73 MAPT (0.45) KMT2AMEN1GAAL3MBTL1CYP1A2
SCHEMBL5381952 0.73 MMP8 (0.47) KMT2AMEN1GAAL3MBTL1CYP1A2

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
EP-0423802-B1 Phenoxy-heterocyclic compounds MERRELL DOW PHARMA (US) 1995-08-09 EP disclosed
CN-1028100-C Process for preparing phenoxy-heterocyclic compounds MIDICINE INST CHINESE MEDICAL (CN) 1995-04-05 CN disclosed
CN-1051039-A Phenoxy group-heterogeneous ring compound MERRELL DOW PHARMA (US) 1991-05-01 CN disclosed
EP-0423802-A1 Phenoxy-heterocyclic compounds MERRELL DOW PHARMACEUTICALS INC. (US) 1991-04-24 EP disclosed