SCHEMBL7635840

SCHEMBL7635840

COc1cccc(OC)c1C(=O)OOC(=O)OCCC(CCOC(=O)OOC(=O)c1c(OC)cccc1OC)COC(=O)OOC(=O)c1c(OC)cccc1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.38
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
GAA P10253 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
ELANE P08246 1/20 0.36
TSHR P16473 1/20 0.35
KDM4E B2RXH2 2/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
PKM P14618 1/20 0.35
POLB P06746 1/20 0.34

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
SCHEMBL7637000 0.90 CA12 (0.41) CA12CA1CA2CA7CA9
SCHEMBL7634217 0.86 L3MBTL1 (0.38) CA12CA1CA2CA7CA9
SCHEMBL7626986 0.86 L3MBTL1 (0.38) CA12CA1CA2CA7CA9
SCHEMBL7625237 0.86 NPC1 (0.41) CA2L3MBTL1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7623954 0.85 KMT2A (0.47) L3MBTL1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL7633087 0.84 CA2 (0.34) CA12CA1CA2CA7CA9
SCHEMBL7624141 0.80 MAPT (0.49) CA12CA1CA2CA7CA9
SCHEMBL7633155 0.79 KMT2A (0.51) KMT2AMEN1ALDH1A1GAAKDM4E
SCHEMBL7630219 0.79 SMN1; SMN2 (0.47) L3MBTL1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL7636375 0.78 SLC29A1 (0.46) KMT2AMEN1ALDH1A1SMN1; SMN2GAA

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