SCHEMBL14944347

SCHEMBL14944347

Bc1ccc(=O)n(-c2ccc(OC)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.44
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 5/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
RECQL P46063 1/20 0.41
KDM4E B2RXH2 3/20 0.41
MAPK14 Q16539 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HCAR1 Q9BXC0 1/20 0.40
HPGD P15428 2/20 0.40
HSD11B1 P28845 2/20 0.40
ATM Q13315 1/20 0.40
TP53 P04637 1/20 0.40
ALOX12 P18054 1/20 0.40
CYP1A2 P05177 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
SCHEMBL16474688 0.81 MEN1 (0.47) MGLLPOLBL3MBTL1ALDH1A1LMNA
SCHEMBL758900 0.81 ALDH1A1 (0.62) MGLLPOLBL3MBTL1ALDH1A1LMNA
SCHEMBL140686 0.79 ALDH1A1 (0.48) MGLLPOLBL3MBTL1ALDH1A1LMNA
SCHEMBL145883 0.77 ALDH1A1 (0.50) MGLLPOLBL3MBTL1ALDH1A1TP53
SCHEMBL12311152 0.77 ALDH1A1 (0.56) MGLLPOLBL3MBTL1ALDH1A1LMNA
SCHEMBL141013 0.76 CMA1 (0.44) MGLLPOLBL3MBTL1ALDH1A1KDM4E
SCHEMBL142343 0.76 MGLL (0.41) MGLLPOLBL3MBTL1ALDH1A1LMNA
SCHEMBL12311153 0.76 TYR (0.46) MGLLALDH1A1LMNAMAPTKDM4E
SCHEMBL16474397 0.76 ALDH1A1 (0.51) POLBL3MBTL1ALDH1A1MAPTKDM4E
SCHEMBL12311154 0.76 CA1 (0.58) POLBALDH1A1MAPTKDM4EMEN1

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
EP-2591784-A1 Pyridine-2-one-derivatives as modulators of stress-activated protein kinase system Intermune, Inc. (US) 2013-05-15 EP disclosed