SCHEMBL3217320

SCHEMBL3217320

C1=CC2CCC1C2.CCCOc1ccc(C=CC(=O)O)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
ALDH1A1 P00352 3/20 0.47
GAA P10253 2/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
HDAC8 Q9BY41 3/20 0.44
ESR1 P03372 2/20 0.43
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41
PPARA Q07869 1/20 0.41
CYP1A1 P04798 1/20 0.39
CYP1B1 Q16678 1/20 0.39
PLA2G2D Q9UNK4 1/20 0.39
POLB P06746 1/20 0.38
S1PR1 P21453 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
LMNA P02545 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL1389296 0.91 KDM4E (0.47) KDM4EALDH1A1GAAKMT2AMEN1
SCHEMBL211526 0.86 PPARG (0.40) KDM4EALDH1A1GAAESR1PPARG
SCHEMBL213132 0.85 THRB (0.44) ALDH1A1GAAKMT2AMEN1HDAC8
SCHEMBL1389238 0.80 ESR1 (0.44) KDM4EALDH1A1GAAKMT2AMEN1
SCHEMBL213294 0.77 TDO2 (0.43) KDM4EESR1CYP1A1CYP1B1SMN1; SMN2
SCHEMBL16440078 0.76 PTGER4 (0.45) ALDH1A1GAAKMT2AMEN1HDAC8
SCHEMBL213053 0.75 THRB (0.44) KDM4EALDH1A1GAAKMT2AMEN1
SCHEMBL16910608 0.75 PTGER3 (0.55) KDM4EALDH1A1KMT2AMEN1HDAC8
SCHEMBL212233 0.74 CA1 (0.46) KDM4EALDH1A1GAAKMT2AHDAC8
SCHEMBL16353477 0.74 PTGER3 (0.40) KDM4EALDH1A1GAAESR1SMN1; SMN2

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
US-20100068419-A1 RETARDATION FILM, A METHOD FOR PREPARING RETARDATION FILM AND POLARIZER COMPRISING THE RETARDATION FILM LG CHEM, LTD. (KR) 2010-03-18 US disclosed
WO-2008130186-A2 A RETARDATION FILM, A METHOD FOR PREPARING RETARDATION FILM AND POLARIZER COMPRISING THE RETARDATION FILM LG CHEM, LTD. (KR) 2008-10-30 WO disclosed