SCHEMBL12469142

SCHEMBL12469142

NC1(OC(=O)C2(C(=O)NC3CC3)CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
POLB P06746 1/20 0.32
EPHX2 P34913 1/20 0.31
HPGD P15428 1/20 0.30

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
SCHEMBL12469141 0.77 EPHX2 (0.42) MAPTPOLBEPHX2HPGD
SCHEMBL28515431 0.74 EPHX2 (0.37) MAPTPOLBEPHX2HPGD
SCHEMBL12469140 0.71 POLB (0.39) MAPTPOLBEPHX2HPGD
SCHEMBL23663375 0.69 EPHX2 (0.39) MAPTPOLBEPHX2HPGD
SCHEMBL13667376 0.66 EPHX1 (0.48) MAPTEPHX2HPGD
SCHEMBL30421849 0.64 SSTR4 (0.41) EPHX2
SCHEMBL28524385 0.63 EPHX1 (0.50) MAPTPOLBEPHX2HPGD
SCHEMBL24307260 0.63 HPGD (0.44) MAPTPOLBEPHX2HPGD
SCHEMBL3620376 0.63 HSD11B1 (0.49) EPHX2HPGD
SCHEMBL30673977 0.62 EPHX1 (0.54) MAPTEPHX2HPGD

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
WO-2012047017-A2 2,3-DIHYDRO-ISOINDOL-1-ONE DERIVATIVE AND A COMPOSITION COMPRISING THE SAME 크리스탈지노믹스(주) (KR) 2012-04-12 WO disclosed