SCHEMBL3866367

SCHEMBL3866367

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
GAA P10253 2/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GRIK1 P39086 2/20 0.35
GRIK2 Q13002 2/20 0.35
ALOX15 P16050 1/20 0.34
MGAM O43451 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
SOAT1 P35610 1/20 0.34
CTSK P43235 2/20 0.34
NR1I2 O75469 1/20 0.33
PGR P06401 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
PTGS2 P35354 1/20 0.33
PDE4D Q08499 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33

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
SCHEMBL11106925 0.83 ALDH1A1 (0.40) ALDH1A1CYP3A4CYP2C19GAALMNA
SCHEMBL134151 0.81 CTSK (0.39) GRIK1GRIK2CTSK
SCHEMBL16213944 0.81 ALDH1A1 (0.39) ALDH1A1GAALMNAHSD17B10GRIK1
SCHEMBL132110 0.81 CTSK (0.39) GRIK1GRIK2CTSK
SCHEMBL1537024 0.80 NR1I2 (0.35) ALDH1A1CYP3A4CYP2C19GAALMNA
SCHEMBL12508071 0.80 NR1I2 (0.35) ALDH1A1CYP3A4CYP2C19GAALMNA
SCHEMBL1537025 0.80 NR1I2 (0.35) ALDH1A1CYP3A4CYP2C19GAALMNA
SCHEMBL3216673 0.79 ADORA3 (0.49) ALDH1A1CYP3A4CYP2C19LMNAHSD17B10
SCHEMBL441964 0.79 ADORA3 (0.49) ALDH1A1CYP3A4CYP2C19LMNAHSD17B10
SCHEMBL27757703 0.79 ALDH1A1 (0.33) ALDH1A1GAALMNAHSD17B10GRIK1

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
EP-2116527-A1 OXIME COMPOUND, PHOTOSENSITIVE COMPOSITION, COLOR FILTER, METHOD FOR PRODUCTION OF THE COLOR FILTER, AND LIQUID CRYSTAL DISPLAY ELEMENT FUJIFILM Corporation (JP) 2009-11-11 EP disclosed
US-20030129504-A1 Photosensitive resin compositon, transfer material, image forming method, color filter and producing method thereof and photomask and producing method thereof FUJI PHOTO FILM CO., LTD. 2003-07-10 US disclosed