SCHEMBL27339552

SCHEMBL27339552

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

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.36
ALDH1A1 P00352 3/20 0.35
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
ALOX15 P16050 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
SOAT1 P35610 1/20 0.32
CYP2D6 P10635 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
GLO1 Q04760 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
SCHEMBL2261094 0.76
SCHEMBL27535425 0.76
SCHEMBL27485572 0.75 ATM (0.45) HCAR2ALDH1A1LMNACA12CA1
SCHEMBL27487130 0.74 TSHR (0.34) ALDH1A1
SCHEMBL9679690 0.72 ALDH1A1 (0.39) HCAR2ALDH1A1LMNAHSD17B10CA12
SCHEMBL9679697 0.72 ALDH1A1 (0.39) HCAR2ALDH1A1LMNAHSD17B10CA12
SCHEMBL27583182 0.72 HCAR2 (0.47) HCAR2ALDH1A1LMNACA12CA1
SCHEMBL15751128 0.70
SCHEMBL7101348 0.70 NPSR1 (0.48) HCAR2ALDH1A1LMNAHSD17B10ALOX15
SCHEMBL1277269 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109199958-A A kind of mosquito repellent kermes 吴澄彬 2019-01-15 CN claimed
CN-101434614-A Compound for manufacturing antireflection film and method for manufacturing antireflection film DAXON TECHNOLOGY INC (CN) 2009-05-20 CN claimed
CN-109199958-A A kind of mosquito repellent kermes 吴澄彬 2019-01-15 CN disclosed
CN-101434614-A Compound for manufacturing antireflection film and method for manufacturing antireflection film DAXON TECHNOLOGY INC (CN) 2009-05-20 CN disclosed
CN-1192009-C Soluble chromophore containing solubilizing group easy to be removed CIBA SC HOLDING AG (CH) 2005-03-09 CN disclosed
CN-1113875-C Substituted aromatic thiocarboxylic acid amides and their use as herbicides BAYER AG (DE) 2003-07-09 CN disclosed
CN-1042136-C Aqueous coatings and processes for production of atuomobile finishes BASF LACKE & FARBEN (DE) 1999-02-17 CN disclosed
CN-1195339-A 4-thiocarbamoyl-1- (3-pyrazolyl) -pyrazoles and their use as herbicides BAYER AG (DE) 1998-10-07 CN disclosed
CN-1148585-A Soluble chromophore containing solubilizing group easy to be removed CIBA GEIGY AG (CH) 1997-04-30 CN disclosed
CN-1071184-A The method of water-based paint and manufacturing automobile finiss BASF LACKE & FARBEN (DE) 1993-04-21 CN disclosed