SCHEMBL3434131

SCHEMBL3434131

CC(=O)Oc1[c]c2ccccc2[c]c1OC(C)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.42
KDM4E B2RXH2 3/20 0.42
HSD17B10 Q99714 3/20 0.42
ALDH1A1 P00352 2/20 0.42
ELANE P08246 1/20 0.42
ESR1 P03372 1/20 0.42
ITGB3 P05106 1/20 0.42
ITGA2B P08514 1/20 0.42
HMGB1 P09429 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
GGT1 P19440 1/20 0.42
PTGS1 P23219 1/20 0.42
BLM P54132 1/20 0.42
NAPRT Q6XQN6 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
GAA P10253 2/20 0.40
MAPT P10636 2/20 0.40
HSP90AA1 P07900 1/20 0.40
LMNA P02545 3/20 0.39

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
SCHEMBL3246397 0.71 KDM4E (0.37) PTGS2KDM4EHSD17B10ALDH1A1ELANE
SCHEMBL29432883 0.69 PTGS2 (0.68) PTGS2KDM4EHSD17B10ALDH1A1ELANE
SCHEMBL338196 0.69 PTGS2 (0.68) PTGS2KDM4EHSD17B10ALDH1A1ELANE
SCHEMBL1451151 0.68 HSD17B10 (0.46) PTGS2KDM4EHSD17B10ALDH1A1ELANE
Iodide SCHEMBL30619798 0.67 PTGS2 (0.65) PTGS2KDM4EHSD17B10ALDH1A1ELANE
Acetic Acid Phenyl Ester SCHEMBL6422166 0.67 ELANE (0.72) PTGS2KDM4EHSD17B10ALDH1A1ELANE
Acetic Acid Phenyl Ester SCHEMBL35500 0.67 ELANE (0.72) PTGS2KDM4EHSD17B10ALDH1A1ELANE
SCHEMBL2435726 0.67 PTGS2 (0.59) PTGS2KDM4EHSD17B10ALDH1A1ESR1
SCHEMBL1452054 0.65 PTGS2 (0.47) PTGS2KDM4EHSD17B10ALDH1A1ESR1
SCHEMBL9672278 0.65 ALDH1A1 (0.43) PTGS2KDM4EHSD17B10ALDH1A1ELANE

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-7718757-B2 Aromatic polymer and producing method thereof SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-05-18 US disclosed
US-20090105445-A1 Aromatic Polymer and Producing Method Thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-04-23 US disclosed