SCHEMBL2909990

SCHEMBL2909990

C=CCCCCCC(OC)(OC)OC

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
ALDH1A1 P00352 4/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 3/20 0.35
ABCC4 O15439 1/20 0.35
LPAR3 Q9UBY5 2/20 0.35
LPAR2 Q9HBW0 1/20 0.35
TRPA1 O75762 2/20 0.33
USP2 O75604 2/20 0.32
CYP3A4 P08684 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
RECQL P46063 1/20 0.32
HPGD P15428 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
SCHEMBL8514127 0.90 TSHR (0.41) TSHRALDH1A1LMNAMAPTABCC4
SCHEMBL8510548 0.90 TSHR (0.41) TSHRALDH1A1LMNAMAPTABCC4
SCHEMBL8513396 0.90 TSHR (0.41) TSHRALDH1A1LMNAMAPTABCC4
SCHEMBL8514521 0.90 TSHR (0.41) TSHRALDH1A1LMNAMAPTABCC4
SCHEMBL8513317 0.90 TSHR (0.41) TSHRALDH1A1LMNAMAPTABCC4
SCHEMBL8514659 0.90 TSHR (0.41) TSHRALDH1A1LMNAMAPTABCC4
SCHEMBL8511119 0.90 TSHR (0.41) TSHRALDH1A1LMNAMAPTABCC4
SCHEMBL8514201 0.87 TSHR (0.38) TSHRALDH1A1LMNA
SCHEMBL8513934 0.83 ALDH1A1 (0.37) TSHRALDH1A1LMNA
SCHEMBL17520209 0.80 TSHR (0.44) TSHRALDH1A1LMNAMAPTABCC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1626998-B1 METHOD FOR PRODUCING AQUEOUS POLYMER DISPERSIONS BASF SE (DE) 2010-09-01 EP disclosed
US-7462673-B2 Method for producing aqueous polymer dispersions BASF AKTIENGESELLSCHAFT (DE) 2008-12-09 US disclosed
US-20070055011-A1 Method for producing aqueous polymer dispersions BASF AKTIENGESELLSCHAFT (DE) 2007-03-08 US disclosed
EP-1626998-A1 METHOD FOR PRODUCING AQUEOUS POLYMER DISPERSIONS BASF AKTIENGESELLSCHAFT (DE) 2006-02-22 EP disclosed
WO-2004101632-A1 METHOD FOR PRODUCING AQUEOUS POLYMER DISPERSIONS BASF AKTIENGESELLSCHAFT (DE) 2004-11-25 WO disclosed