SCHEMBL6534142

SCHEMBL6534142

O=C(OC1C(c2ccccc2)=Cc2c(O)ccc3cccc1c23)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.38
MAPT P10636 3/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
EPHX1 P07099 1/20 0.32
EGFR P00533 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
CNR2 P34972 1/20 0.31
JAK2 O60674 1/20 0.31
USP2 O75604 1/20 0.31
ESR1 P03372 1/20 0.31
GAA P10253 1/20 0.31
ALOX15 P16050 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ESR2 Q92731 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PTPN1 P18031 1/20 0.31

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
SCHEMBL6533677 0.85 PPARG (0.39) PPARGMAPTMEN1KMT2ATDP1
SCHEMBL6534139 0.79 ESR1 (0.37) PPARGMAPTMEN1KMT2AEGFR
SCHEMBL9282200 0.68 KMT2A (0.38) PPARGMAPTMEN1KMT2ATDP1
SCHEMBL21778844 0.64 F2 (0.50) MAPTMEN1KMT2ATDP1GAA
SCHEMBL6533674 0.63 ESR1 (0.37) PPARGMAPTMEN1KMT2ATDP1
SCHEMBL24279060 0.61 GAA (0.43) PPARGMAPTMEN1KMT2ATDP1
SCHEMBL27112424 0.61 GAA (0.43) PPARGMAPTMEN1KMT2ATDP1
SCHEMBL24278694 0.61 OPRM1 (0.43) PPARGMEN1KMT2AEPHX1GAA
SCHEMBL27053120 0.61 PPARG (0.40) PPARGMAPTMEN1KMT2ATDP1
SCHEMBL24278696 0.61 CHRNA7 (0.40) PPARGMEN1KMT2AEPHX1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1572716-A4 METHODS FOR SYNTHESIS OF LIQUID CRYSTALS SOUTHWEST RES INST (US) 2005-09-14 EP disclosed
EP-1572716-A2 METHODS FOR SYNTHESIS OF LIQUID CRYSTALS Southwest Research Institute (US) 2005-09-14 EP disclosed
WO-2002066493-A2 METHODS FOR SYNTHESIS OF LIQUID CRYSTALS SOUTHWEST RESEARCH INSTITUTE (US) 2002-08-29 WO disclosed