SCHEMBL4705765

SCHEMBL4705765

[CH2][C@@H]1c2ccccc2C[C@H]1NC(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.49
KDM1A O60341 2/20 0.43
MAOB P27338 2/20 0.43
DRD2 P14416 3/20 0.41
ATM Q13315 1/20 0.41
NFKB1 P19838 2/20 0.40
NFKB2 Q00653 2/20 0.40
RELA Q04206 2/20 0.40
KMT2A Q03164 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NAMPT P43490 2/20 0.39
KCNA3 P22001 1/20 0.38
MAOA P21397 1/20 0.38
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
GAA P10253 1/20 0.36
CKS1B P61024 1/20 0.35
SKP1 P63208 1/20 0.35

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
SCHEMBL8635461 0.83 EPHX2 (0.49) EPHX2KDM1AMAOBDRD2ATM
SCHEMBL14348198 0.83 EPHX2 (0.49) EPHX2KDM1AMAOBDRD2ATM
SCHEMBL7328550 0.83 EPHX2 (0.49) EPHX2KDM1AMAOBDRD2ATM
SCHEMBL8310630 0.83 EPHX2 (0.49) EPHX2KDM1AMAOBDRD2ATM
SCHEMBL14016078 0.82 EPHX2 (0.48) EPHX2KDM1AMAOBDRD2ATM
SCHEMBL4654164 0.82 EPHX2 (0.48) EPHX2KDM1AMAOBDRD2ATM
SCHEMBL7423742 0.82 EPHX2 (0.48) EPHX2KDM1AMAOBDRD2ATM
SCHEMBL4914877 0.81 EPHX2 (0.47) EPHX2KDM1AMAOBDRD2ATM
SCHEMBL14015839 0.81 EPHX2 (0.47) EPHX2KDM1AMAOBDRD2ATM
SCHEMBL5034414 0.81 EPHX2 (0.47) EPHX2KDM1AMAOBDRD2ATM

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-1658069-B1 HETEROCYCLIC AMIDE DERIVATIVES WHICH POSSESS GLYCOGEN PHOSPHORYLASE INHIBITORY ACTIVITY ASTRAZENECA AB (SE) 2008-07-30 EP disclosed