SCHEMBL28026772

SCHEMBL28026772

OCc1nc2ccccc2cc1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
KDM4E B2RXH2 4/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
HPGD P15428 2/20 0.45
GLA P06280 1/20 0.45
MAPT P10636 1/20 0.45
ACHE P22303 1/20 0.45
PDE10A Q9Y233 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
LMNA P02545 1/20 0.42
ATM Q13315 1/20 0.42
AKT1 P31749 1/20 0.41
PSMB5 P28074 3/20 0.41
GAA P10253 1/20 0.39
STAT3 P40763 1/20 0.39
BACE1 P56817 1/20 0.39

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
SCHEMBL9129527 0.84 ALDH1A1 (0.47) ALDH1A1KDM4EL3MBTL1TDP1HPGD
SCHEMBL28214650 0.82 ALDH1A1 (0.46) ALDH1A1KDM4EL3MBTL1TDP1HPGD
SCHEMBL10505834 0.78 ALDH1A1 (0.40) ALDH1A1KDM4EL3MBTL1TDP1HPGD
SCHEMBL10507885 0.78 LTB4R (0.48) ALDH1A1KDM4EL3MBTL1MEN1KMT2A
SCHEMBL7927501 0.77 ALDH1A1 (0.48) ALDH1A1KDM4ETDP1HPGDGLA
SCHEMBL8878501 0.77 ALDH1A1 (0.55) ALDH1A1KDM4EL3MBTL1TDP1HPGD
SCHEMBL29370497 0.77 ALDH1A1 (0.48) ALDH1A1KDM4ETDP1HPGDGLA
SCHEMBL5258959 0.77 ALDH1A1 (0.51) ALDH1A1KDM4EL3MBTL1TDP1HPGD
SCHEMBL29103979 0.76 TLR8 (0.51) ALDH1A1KDM4EL3MBTL1TDP1PSMB5
SCHEMBL26309770 0.76 CYP19A1 (0.45) ALDH1A1KDM4EL3MBTL1TDP1HPGD

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
CN-104829526-A Fluorescent probe compound and preparation method and application of fluorescent probe compound UNIV BEIJING AGRICULT 2015-08-12 CN claimed
CN-104829526-A Fluorescent probe compound and preparation method and application of fluorescent probe compound UNIV BEIJING AGRICULT 2015-08-12 CN disclosed