SCHEMBL7625871

SCHEMBL7625871

CCCC(COC(=O)OOC(=O)c1c(C)cccc1C)(COC(=O)OOC(=O)c1c(C)cccc1C)COC(=O)OOC(=O)c1c(C)cccc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
MAPK1 P28482 2/20 0.35
HIF1A Q16665 1/20 0.35
NLRP3 Q96P20 3/20 0.35
CYP1A2 P05177 1/20 0.34
ELANE P08246 1/20 0.34
TSHR P16473 1/20 0.33
F2R P25116 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
TAS1R2 Q8TE23 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.31
GAA P10253 2/20 0.31
MAPT P10636 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
SCHEMBL7631096 0.91 MAPK1 (0.42) CA12CA1CA2CA7CA9
SCHEMBL7635709 0.90 MAPK1 (0.39) CA12CA1CA2CA7CA9
SCHEMBL7631687 0.87 L3MBTL1 (0.35) NLRP3CYP1A2ELANEALDH1A1LMNA
SCHEMBL7631348 0.87 KMT2A (0.41) MAPK1NLRP3TSHRALDH1A1GAA
SCHEMBL7633069 0.86 TSHR (0.41) MAPK1HIF1ATSHRALDH1A1LMNA
SCHEMBL7625431 0.85 CA12 (0.41) CA12CA1CA2CA7CA9
SCHEMBL7630962 0.84 CA12 (0.38) CA12CA1CA2CA7CA9
SCHEMBL7625625 0.84 KMT2A (0.31) LMNA
SCHEMBL7630003 0.81 ADRB2 (0.42) MAPK1HIF1AELANETSHRTAS1R3
SCHEMBL7627195 0.81 MAPK1 (0.54) MAPK1HIF1ACYP1A2TSHRALDH1A1

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
EP-1233014-A1 ASYMMETRIC ORGANIC PEROXIDE, CROSSLINKING AGENT COMPRISING THE SAME, AND METHOD OF CROSSLINKING WITH THE SAME NOF CORPORATION (JP) 2002-08-21 EP disclosed