SCHEMBL3766819

SCHEMBL3766819

CCCCC(=C(C)C(=O)O)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 2/20 0.47
FNTB P49356 2/20 0.47
THRB P10828 1/20 0.47
PGGT1B P53609 1/20 0.47
CES1 P23141 2/20 0.41
CES2 O00748 1/20 0.41
ALDH1A1 P00352 3/20 0.38
AKR1B1 P15121 1/20 0.38
TP53 P04637 1/20 0.38
GPR84 Q9NQS5 7/20 0.37
PPARG P37231 6/20 0.37
PPARD Q03181 6/20 0.37
PPARA Q07869 6/20 0.37
HDAC11 Q96DB2 5/20 0.37
TSHR P16473 4/20 0.37
TLR2 O60603 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
FABP4 P15090 2/20 0.37
PTPN1 P18031 2/20 0.37
SLC22A6 Q4U2R8 1/20 0.37

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
SCHEMBL23357834 0.92 FNTA (0.58) FNTAFNTBTHRBPGGT1BCES1
SCHEMBL1904064 0.84 FNTA (0.44) FNTAFNTBTHRBPGGT1BCES1
SCHEMBL28271941 0.82 CES1 (0.40) FNTAFNTBTHRBPGGT1BCES1
SCHEMBL5073159 0.79 FNTA (0.56) FNTAFNTBTHRBPGGT1BALDH1A1
SCHEMBL6544625 0.77 FNTA (0.55) FNTAFNTBTHRBPGGT1BCES1
SCHEMBL28387908 0.76 ALDH1A1 (0.47) CES1CES2ALDH1A1TSHRTDP1
SCHEMBL538691 0.76 FNTA (0.53) FNTAFNTBTHRBPGGT1BCES1
SCHEMBL7794891 0.76 FNTA (0.53) FNTAFNTBTHRBPGGT1BCES1
SCHEMBL4157068 0.75 CES2 (0.46) FNTAFNTBTHRBPGGT1BCES1
Phosphoric Acid SCHEMBL21408817 0.73 FNTA (0.50) FNTAFNTBTHRBPGGT1BALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100310857-A1 Inorganic-polymer composite material, adhesive layer, and adhesive film NITTO DENKO CORPORATION (JP) 2010-12-09 US disclosed