SCHEMBL4817136

SCHEMBL4817136

C=C(C)C(=O)CC(=O)CC

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.45
ALDH1A1 P00352 3/20 0.38
HSD17B10 Q99714 1/20 0.32
FFAR3 O14843 1/20 0.32
HAO1 Q9UJM8 1/20 0.31
THRB P10828 1/20 0.31
TSHR P16473 3/20 0.31
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
TGFBR1 P36897 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
SCHEMBL16140641 0.80 ALDH1A1 (0.45) TDP1ALDH1A1HSD17B10THRBTSHR
SCHEMBL3135275 0.79 KDM4E (0.42) TDP1ALDH1A1MGAMGAASI
SCHEMBL6383200 0.78
SCHEMBL31544771 0.78 TDP1 (0.50) TDP1ALDH1A1FFAR3HAO1TSHR
SCHEMBL134267 0.77
SCHEMBL12313470 0.77 TDP1 (0.43) TDP1ALDH1A1HSD17B10FFAR3THRB
SCHEMBL515405 0.75
Hydrogen Sulfide SCHEMBL28267233 0.75
SCHEMBL20548488 0.75 TDP1 (0.53) TDP1ALDH1A1HSD17B10FFAR3TSHR
SCHEMBL13657836 0.74 TDP1 (0.45) TDP1ALDH1A1HSD17B10FFAR3TSHR

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-20080009582-A1 PROCESS FOR PRODUCING POLYMER, COATING COMPOSITION AND COATED ARTICLE ASAHI GLASS CO., LTD. (JP) 2008-01-10 US disclosed
EP-1852444-A1 METHOD FOR PRODUCING POLYMER, COATING COMPOSITION AND COATED ARTICLE Asahi Glass Company, Limited (JP) 2007-11-07 EP disclosed