SCHEMBL6895196

SCHEMBL6895196

C=C(COCC)C(=O)OCCOCCOCCO

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.53
ALDH1A1 P00352 6/20 0.43
TSHR P16473 8/20 0.41
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HTT P42858 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.34
TP53 P04637 2/20 0.33
HIF1A Q16665 2/20 0.33
HSD17B10 Q99714 1/20 0.33
EPHX2 P34913 1/20 0.32
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 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
SCHEMBL6895187 0.88 THRB (0.43) THRBALDH1A1TSHRMEN1KMT2A
SCHEMBL5595387 0.88 THRB (0.42) THRBALDH1A1TSHRMEN1KMT2A
SCHEMBL1831359 0.88 THRB (0.42) THRBALDH1A1TSHRMEN1KMT2A
SCHEMBL824139 0.84 THRB (0.42) THRBALDH1A1TSHRMEN1KMT2A
SCHEMBL6897824 0.84 THRB (0.42) THRBALDH1A1TSHRMEN1KMT2A
SCHEMBL6899277 0.84 THRB (0.42) THRBALDH1A1TSHRMEN1KMT2A
SCHEMBL9690995 0.84 THRB (0.48) THRBALDH1A1TSHRMEN1KMT2A
SCHEMBL1831709 0.84 ALDH1A1 (0.43) THRBALDH1A1TSHRKMT2AMAPT
SCHEMBL6036910 0.84 THRB (0.48) THRBALDH1A1TSHRMEN1KMT2A
SCHEMBL7622066 0.83 TSHR (0.50) THRBALDH1A1TSHRMEN1KMT2A

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