SCHEMBL3890706

SCHEMBL3890706

C=Cc1cccc(C(CC2CO2)OC(CC2CO2)c2cccc(C=C)c2)c1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP3A4 P08684 1/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HIF1A Q16665 1/20 0.34
PTGS2 P35354 1/20 0.30

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
SCHEMBL28297908 0.82 TP53 (0.36) TP53TDP1ALDH1A1CYP3A4TSHR
SCHEMBL3901257 0.82 ALDH1A1 (0.35) ALDH1A1
SCHEMBL4464586 0.76 TDP1 (0.44) TP53TDP1ALDH1A1CYP3A4TSHR
SCHEMBL2058773 0.75 ALDH1A1 (0.39) TP53TDP1ALDH1A1CYP3A4TSHR
SCHEMBL1357184 0.75 TP53 (0.37) TP53TDP1ALDH1A1TSHRPTGS2
SCHEMBL10454538 0.73 TP53 (0.38) TP53TDP1ALDH1A1TSHRPTGS2
SCHEMBL1357315 0.70 TP53 (0.37) TP53TDP1PTGS2
SCHEMBL2394506 0.69 ALDH1A1 (0.70) TP53TDP1ALDH1A1CYP3A4TSHR
SCHEMBL29547473 0.69 ALDH1A1 (0.70) TP53TDP1ALDH1A1CYP3A4TSHR
SCHEMBL9331235 0.68 ALDH1A1 (0.42) TP53TDP1ALDH1A1CYP3A4TSHR

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-1396504-B1 Polyolefin macromonomer, graft polymer obtained from the polyolefin macromonomer, and use thereof MITSUI CHEMICALS INC (JP) 2009-01-14 EP disclosed
US-7067587-B2 Polyolefin macromonomer, graft polymer obtained from the polyolefin macromonomer, and use thereof MITSUI CHEMICALS, INC. (JP) 2006-06-27 US disclosed
US-20040242791-A1 Polyolefin macromonomer, graft polymer obtained from the polyolefin macromonomer, and use thereof MITSUI CHEMICALS, INC. (JP) 2004-12-02 US disclosed
EP-1396504-A2 Polyolefin macromonomer, graft polymer obtained from the polyolefin macromonomer, and use thereof Mitsui Chemicals, Inc. (JP) 2004-03-10 EP disclosed