SCHEMBL9615566

SCHEMBL9615566

C=C(C)C(=O)OCC(C)(COC(=O)C(=C)C)COC(=O)c1cccc(C(=O)O)c1C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.36
ALDH1A1 P00352 5/20 0.35
TDP1 Q9NUW8 3/20 0.35
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
TSHR P16473 4/20 0.33
KDM4E B2RXH2 3/20 0.32
HSD17B10 Q99714 3/20 0.32
MAPK1 P28482 2/20 0.32
HPGD P15428 2/20 0.32
HIF1A Q16665 1/20 0.32
CDC25B P30305 1/20 0.32
LMNA P02545 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP3A4 P08684 1/20 0.31
ESR1 P03372 1/20 0.31
ITGB3 P05106 1/20 0.31
ITGA2B P08514 1/20 0.31

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
SCHEMBL9615553 0.91 MAPK1 (0.42) ALOX15ALDH1A1TDP1POLBAPEX1
SCHEMBL9615548 0.88 ALDH1A1 (0.48) ALOX15ALDH1A1TDP1POLBAPEX1
SCHEMBL9615570 0.88 MAPK1 (0.39) ALDH1A1TDP1POLBAPEX1HTT
SCHEMBL10585165 0.84 ALDH1A1 (0.39) ALDH1A1TDP1POLBAPEX1HTT
SCHEMBL4882782 0.84 TSHR (0.44) ALDH1A1TDP1POLBAPEX1HTT
SCHEMBL1173737 0.82 TDP1 (0.51) ALDH1A1TDP1POLBAPEX1HTT
SCHEMBL4872508 0.81 TDP1 (0.53) ALDH1A1TDP1POLBAPEX1HTT
SCHEMBL4882801 0.81 TDP1 (0.53) ALDH1A1TDP1POLBAPEX1HTT
SCHEMBL9615563 0.79 ALDH1A1 (0.49) ALOX15ALDH1A1TDP1POLBAPEX1
SCHEMBL11018360 0.77 TSHR (0.43) ALDH1A1TDP1POLBAPEX1HTT

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-5096799-A Carboxy grou-containing binder, photoinitiator with lophine dimer, carboxy and ester group-containing compound to prevent discoloration, monomer; storage stable FUJI PHOTO FILM CO., LTD. (JP) 1992-03-17 US disclosed