SCHEMBL15548208

SCHEMBL15548208

CC(C)CCC(=O)Oc1cccc(OC(C)C)c1OC(=O)CCC(C)C.CCCCOc1cccc(OC(=O)CCC(C)C)c1OC(=O)CCC(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
RECQL P46063 1/20 0.40
PPARG P37231 4/20 0.38
LMNA P02545 2/20 0.38
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PTGES O14684 3/20 0.38
ALOX5 P09917 3/20 0.38
POLM Q9NP87 1/20 0.38
POLK Q9UBT6 1/20 0.38
POLL Q9UGP5 1/20 0.38
POLH Q9Y253 1/20 0.38
HTT P42858 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
AKR1C3 P42330 1/20 0.37
CNR2 P34972 3/20 0.36

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
SCHEMBL15547773 0.94 KMT2A (0.45) KDM4EMEN1KMT2ARECQLPPARG
SCHEMBL15548964 0.90 PPARG (0.46) KDM4EMEN1KMT2ARECQLPPARG
SCHEMBL15558769 0.89 PPARG (0.48) KDM4EMEN1KMT2ARECQLPPARG
SCHEMBL15547286 0.89 PPARG (0.48) KDM4EMEN1KMT2ARECQLPPARG
SCHEMBL15558337 0.89 PPARG (0.48) KDM4EMEN1KMT2ARECQLPPARG
SCHEMBL15547585 0.89 PPARG (0.48) KDM4EMEN1KMT2ARECQLPPARG
SCHEMBL15558178 0.89 PPARG (0.48) KDM4EMEN1KMT2ARECQLPPARG
SCHEMBL15558354 0.89 PPARG (0.48) KDM4EMEN1KMT2ARECQLPPARG
SCHEMBL15548716 0.89 PPARG (0.48) KDM4EMEN1KMT2ARECQLPPARG
SCHEMBL15546874 0.89 PPARG (0.48) KDM4EMEN1KMT2ARECQLPPARG

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
EP-2872538-A1 ZIEGLER-NATTA CATALYST SYSTEMS COMPRISING A 1,2-PHENYLENEDIOATE AS INTERNAL DONOR AND PROCESS FOR PREPARING THE SAME Indian Oil Corporation Ltd (IN) 2015-05-20 EP disclosed
WO-2014013401-A1 ZIEGLER-NATTA CATALYST SYSTEMS COMPRISING A 1,2-PHENYLENEDIOATE AS INTERNAL DONOR AND PROCESS FOR PREPARING THE SAME INDIAN OIL CORPORATION LIMITED (IN) 2014-01-23 WO disclosed