SCHEMBL6898989

SCHEMBL6898989

C=C(COc1ccccc1)C(=O)OCCOCCOCCO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.46
ALDH1A1 P00352 2/20 0.46
ALOX15 P16050 1/20 0.45
THRB P10828 1/20 0.43
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
GAA P10253 3/20 0.41
KDM4E B2RXH2 2/20 0.40
TSHR P16473 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALPL P05186 1/20 0.38
ALPI P09923 1/20 0.38
ALPG P10696 1/20 0.38
HPGD P15428 2/20 0.38
LMNA P02545 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38

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
SCHEMBL29182462 0.86 THRB (0.57) RECQLALDH1A1ALOX15THRBKMT2A
SCHEMBL12760862 0.82 ALDH1A1 (0.56) RECQLALDH1A1ALOX15THRBKMT2A
SCHEMBL11243219 0.82 ALDH1A1 (0.56) RECQLALDH1A1ALOX15THRBKMT2A
SCHEMBL1835452 0.79 ALDH1A1 (0.41) RECQLALDH1A1THRBKMT2AMEN1
SCHEMBL183505 0.79 ALDH1A1 (0.41) RECQLALDH1A1THRBKMT2AMEN1
SCHEMBL1614166 0.79 ALDH1A1 (0.41) RECQLALDH1A1THRBKMT2AMEN1
SCHEMBL181509 0.79 ALDH1A1 (0.41) RECQLALDH1A1THRBKMT2AMEN1
SCHEMBL352600 0.79 THRB (0.52) ALDH1A1ALOX15THRBKMT2AMEN1
SCHEMBL7182348 0.78 RECQL (0.55) RECQLALDH1A1THRBKMT2AMEN1
SCHEMBL26130421 0.77 THRB (0.57) RECQLALDH1A1ALOX15THRBKMT2A

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-20040079926-A1 Mixture of polymer and metal compound in solvent; applying to glass sheet NIPPON OIL CORPORATION (JP) 2004-04-29 US disclosed
EP-1363293-A1 IONICALLY CONDUCTING SHEET Nippon Oil Corporation (JP) 2003-11-19 EP disclosed