SCHEMBL11286363

SCHEMBL11286363

CC(Oc1ccccc1)C(=O)OCC1CO1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.50
▸ MGLL Q99685 5/20 0.48
▸ LMNA P02545 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ MAPT P10636 1/20 0.45
▸ MTNR1A P48039 1/20 0.43
▸ MTNR1B P49286 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ POLB P06746 1/20 0.43

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
SCHEMBL17901029 0.76 LMNA (0.72) TDP1LMNAL3MBTL1MAPTMTNR1A
SCHEMBL25437242 0.76 LMNA (0.55) TDP1LMNAL3MBTL1MAPTMTNR1A
SCHEMBL2805987 0.76 LMNA (0.72) TDP1LMNAL3MBTL1MAPTMTNR1A
SCHEMBL516278 0.75 TDP1 (0.56) TDP1MGLL
SCHEMBL13444677 0.74 LMNA (0.54) TDP1LMNAL3MBTL1MAPTMTNR1A
SCHEMBL28257654 0.74 LMNA (0.54) TDP1LMNAL3MBTL1MAPTMTNR1A
SCHEMBL11204111 0.73 MEN1 (0.51) MGLLLMNAL3MBTL1MAPTGAA
SCHEMBL10553638 0.73 GAA (0.56) TDP1LMNAL3MBTL1MAPTMTNR1A
SCHEMBL16673235 0.73 LMNA (0.56) TDP1LMNAL3MBTL1MAPTMTNR1A
Acetone SCHEMBL6444169 0.73 TDP1 (0.79) TDP1MGLLLMNAMAPTCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-57203066-A — — None — — JP disclosed
JP-S57203066-A PHENOXYPROPIONIC ACID GLYCIDYL ESTER DERIVATIVE, ITS PREPARATION AND HERBICIDE NISSAN CHEM IND LTD 1982-12-13 — — JP disclosed
Send feedback