SCHEMBL366329

SCHEMBL366329

CCOC(=O)c1c2ccccc2n2cc(OCCN3CCCCC3)ccc12

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
KCNH2 Q12809 1/20 0.49
HRH3 Q9Y5N1 1/20 0.49

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
SCHEMBL365361 0.90 PPARG (0.49) KDM4E
SCHEMBL366327 0.84 MAPT (0.63) KDM4E
SCHEMBL365439 0.83 KDM4E (0.48) KDM4E
SCHEMBL365062 0.82 TSHR (0.42)
SCHEMBL364682 0.81 KMT2A (0.58) KDM4E
SCHEMBL365132 0.81 ALDH1A1 (0.46) KDM4E
SCHEMBL364758 0.81 MEN1 (0.44) KDM4E
SCHEMBL366943 0.81 KDM4E (0.46) KDM4E
SCHEMBL364878 0.80 SMN1; SMN2 (0.55) KDM4E
SCHEMBL365760 0.80 KDM4E (0.53) KDM4E

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
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed