SCHEMBL23453076

SCHEMBL23453076

CSOC(=O)CC1CC2C=CC1C2

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.38
LMNA P02545 1/20 0.38
ALDH1A1 P00352 4/20 0.37
EPHX2 P34913 3/20 0.36
POLB P06746 1/20 0.35
ALOX15 P16050 1/20 0.35
TDP1 Q9NUW8 3/20 0.35
PKM P14618 2/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
MEN1 O00255 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL1087617 0.81 EPHX2 (0.41) KDM4ELMNAALDH1A1EPHX2POLB
SCHEMBL1089531 0.79 KDM4E (0.41) KDM4ELMNAALDH1A1EPHX2POLB
SCHEMBL26935789 0.78 EPHX2 (0.38) KDM4ELMNAALDH1A1EPHX2POLB
SCHEMBL4379431 0.77 KDM4E (0.38) KDM4ELMNAALDH1A1EPHX2POLB
SCHEMBL13019213 0.77 KDM4E (0.38) KDM4ELMNAALDH1A1EPHX2POLB
SCHEMBL4377524 0.77 KDM4E (0.41) KDM4ELMNAALDH1A1EPHX2POLB
SCHEMBL4739740 0.76 KDM4E (0.40) KDM4ELMNAALDH1A1EPHX2POLB
SCHEMBL3675886 0.75 KDM4E (0.43) KDM4ELMNAALDH1A1EPHX2POLB
SCHEMBL8464466 0.75 KDM4E (0.42) KDM4ELMNAALDH1A1EPHX2POLB
SCHEMBL15498477 0.75 KDM4E (0.41) KDM4ELMNAALDH1A1EPHX2POLB

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-2021105723-A1 NOVEL LINKER COMPOUNDS CAMBRIDGE ENTERPRISE LIMITED (GB) 2021-06-03 WO disclosed