SCHEMBL6933189

SCHEMBL6933189

CCCCCCCCCC(=O)Oc1ccc(C(=O)Oc2ccc(C(=O)OCCC(C)C)c(F)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.42
MAPT P10636 3/20 0.42
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
CYP1A2 P05177 2/20 0.41
CYP2D6 P10635 2/20 0.41
SLC22A2 O15244 1/20 0.41
TMPRSS2 O15393 1/20 0.41
F2 P00734 1/20 0.41
F10 P00742 1/20 0.41
PLG P00747 1/20 0.41
F12 P00748 1/20 0.41
PLAU P00749 1/20 0.41
PLAT P00750 1/20 0.41
KLKB1 P03952 1/20 0.41
HPN P05981 1/20 0.41
CHRM2 P08172 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41

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
SCHEMBL6940301 0.93 KMT2A (0.41) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL8200469 0.91 KMT2A (0.46) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL8190500 0.91 MAPT (0.51) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL8201150 0.91 MAPT (0.51) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL8201026 0.91 MAPT (0.51) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL8216532 0.87 MAPT (0.51) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL8190514 0.87 MAPT (0.51) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL7798766 0.85 ALDH1A1 (0.46) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL7796053 0.85 ALDH1A1 (0.46) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL7797623 0.85 ALDH1A1 (0.46) KMT2AMAPTMEN1ALDH1A1HPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0994097-B1 Novel phenyl triester compound and anti-ferroelectric liquid crystal composition containing the same MITSUBISHI GAS CHEMICAL CO (JP) 2003-09-03 EP disclosed
US-6217954-B1 AROMATIC TRIESTERS WITH ANTIFERROELECTRIC LIQUID CRYSTALS MITSUBISHI GAS CHEMICAL CO INC (JP) 2001-04-17 US disclosed
JP-2000186064-A PHENYL TRI-ESTER COMPOUND AND ANTIFERROELECTRIC LIQUID CRYSTAL COMPOSITION INCLUDING THE SAME MITSUBISHI GAS CHEM CO INC 2000-07-04 JP disclosed
EP-0994097-A2 Novel phenyl triester compound and anti-ferroelectric liquid crystal composition containing the same MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2000-04-19 EP disclosed