SCHEMBL14756756

SCHEMBL14756756

Cc1cc(=O)oc2c(C(C)C)c(OC(=O)C(C)C)ccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.58
GAA P10253 8/20 0.58
HPGD P15428 6/20 0.58
KMT2A Q03164 6/20 0.58
HSD17B10 Q99714 5/20 0.58
GLA P06280 3/20 0.58
LMNA P02545 2/20 0.58
MAPK1 P28482 2/20 0.58
ALDH1A1 P00352 8/20 0.53
TSHR P16473 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
MCL1 Q07820 2/20 0.51
MAPT P10636 6/20 0.50
CASP1 P29466 2/20 0.50
CASP7 P55210 2/20 0.50
TP53 P04637 2/20 0.49
HTT P42858 1/20 0.49
FHIT P49789 1/20 0.49
PAX8 Q06710 1/20 0.48
MAOB P27338 2/20 0.48

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
SCHEMBL15984892 0.88 KDM4E (0.74) KDM4EGAAHPGDKMT2AHSD17B10
SCHEMBL14756285 0.82 KDM4E (0.62) KDM4EGAAHPGDKMT2AHSD17B10
SCHEMBL6993105 0.74 KDM4E (0.73) KDM4EGAAHPGDKMT2AHSD17B10
SCHEMBL17716513 0.74 HSD17B10 (0.55) KDM4EGAAHPGDKMT2AHSD17B10
SCHEMBL8835293 0.73 KDM4E (0.71) KDM4EGAAHPGDKMT2AHSD17B10
SCHEMBL27788739 0.72 ALDH1A1 (0.77) KDM4EGAAHPGDKMT2AHSD17B10
SCHEMBL7917900 0.71 KDM4E (0.68) KDM4EGAAHPGDKMT2AHSD17B10
SCHEMBL12858955 0.71 MAOB (0.67) KDM4EGAAHPGDKMT2AHSD17B10
SCHEMBL3052874 0.70 KDM4E (0.68) KDM4EGAAHPGDKMT2AHSD17B10
SCHEMBL27079801 0.70 KDM4E (0.79) KDM4EGAAHPGDKMT2AHSD17B10

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-2013033270-A2 BROMODOMAIN LIGANDS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME COFERON, INC. (US) 2013-03-07 WO disclosed