SCHEMBL17833874

SCHEMBL17833874

CCC(CC)(CC)CC(OCCOc1ccccc1)OC(=O)C(C)(C)CC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.40
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PKM P14618 1/20 0.38
RAB9A P51151 2/20 0.38
MAPT P10636 1/20 0.38
KDM4E B2RXH2 3/20 0.37
PARP10 Q53GL7 1/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
RECQL P46063 1/20 0.36
POLB P06746 4/20 0.36
HTR1A P08908 1/20 0.36
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 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
SCHEMBL16591031 0.89 PPARA (0.43) PPARALMNAMAPK1L3MBTL1TDP1
SCHEMBL16746676 0.88 KDM4E (0.40) PPARALMNAMAPK1L3MBTL1TDP1
SCHEMBL20411149 0.82 PPARA (0.44) PPARALMNAMAPK1L3MBTL1TDP1
SCHEMBL16591047 0.82 FKBP1A (0.42) LMNAPOLB
SCHEMBL16591063 0.80 PPARA (0.42) PPARALMNAMAPK1L3MBTL1TDP1
SCHEMBL17833873 0.76 ALDH1A1 (0.36) PPARALMNATDP1PKMKDM4E
SCHEMBL116844 0.76 THRB (0.51) PPARALMNAMAPK1L3MBTL1TDP1
SCHEMBL16590994 0.73 KDM4E (0.38) PPARALMNATDP1PKMKDM4E
SCHEMBL11306567 0.72 KDM4E (0.48) PPARALMNATDP1PKMRAB9A
SCHEMBL18219828 0.72 KDM4E (0.48) PPARALMNATDP1PKMRAB9A

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-9746771-B2 Laminate body FUJIFILM CORPORATION (JP) 2017-08-29 US disclosed
US-20160170303-A1 LAMINATE BODY FUJIFILM CORPORATION (JP) 2016-06-16 US disclosed