SCHEMBL28618043

SCHEMBL28618043

C=COC(CS)C(=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 1/20 0.38
ALDH1A1 P00352 4/20 0.34
GLO1 Q04760 1/20 0.34
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
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
NPSR1 Q6W5P4 2/20 0.32
HCAR2 Q8TDS4 1/20 0.31
TSHR P16473 1/20 0.31
TRPA1 O75762 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 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
SCHEMBL7770888 0.84 ALDH1A1 (0.37) ALDH1A1GLO1LMNAHSD17B10ALOX15
SCHEMBL8945048 0.81 POLB (0.35) CPB2ALDH1A1GLO1LMNAHSD17B10
SCHEMBL28241414 0.79 ALDH1A1 (0.33) CPB2ALDH1A1GLO1LMNAHSD17B10
SCHEMBL28606391 0.78 CPB2 (0.36) CPB2ALDH1A1GLO1LMNAHSD17B10
SCHEMBL28618055 0.78 CPB2 (0.33) CPB2GLO1LMNA
SCHEMBL27697061 0.75 CPB2 (0.42) CPB2ALDH1A1GLO1LMNAHSD17B10
SCHEMBL7770966 0.74 ALDH1A1 (0.39) ALDH1A1LMNAHSD17B10ALOX15MGAM
SCHEMBL28611937 0.72 TDP1 (0.35) CPB2ALDH1A1LMNAHSD17B10NPSR1
SCHEMBL28618850 0.71 TDP1 (0.34) CPB2ALDH1A1LMNAHSD17B10TSHR
SCHEMBL8128351 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113248953-B Photoconversion curable composition, cured film, quantum dot light-emitting diode, and image display device 东友精细化工有限公司 2023-02-21 CN disclosed
CN-113248953-A Photoconversion curable composition, cured film, quantum dot light-emitting diode, and image display device 东友精细化工有限公司 2021-08-13 CN disclosed
CN-113249112-A Quantum dots and applications thereof 东友精细化工有限公司 2021-08-13 CN disclosed