SCHEMBL3193869

SCHEMBL3193869

O=C(CCCOCCO)Oc1ccccc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ GAA P10253 3/20 0.41
▸ JAK2 O60674 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ POLB P06746 1/20 0.38
▸ CA1 P00915 2/20 0.37
▸ CA12 O43570 1/20 0.37
▸ CA7 P43166 1/20 0.37
▸ CA14 Q9ULX7 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.36
▸ PTGS2 P35354 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ IDO1 P14902 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35

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
SCHEMBL4646991 0.87 KMT2A (0.47) KMT2AKDM4EMEN1RECQLGAA
SCHEMBL4645745 0.85 KMT2A (0.46) KMT2AKDM4EMEN1RECQLGAA
SCHEMBL689958 0.85 KMT2A (0.51) KMT2AKDM4EMEN1RECQLGAA
SCHEMBL4644726 0.83 GAA (0.48) KMT2AKDM4EMEN1RECQLGAA
SCHEMBL688230 0.83 KMT2A (0.50) KMT2AKDM4EMEN1RECQLGAA
SCHEMBL688760 0.83 KMT2A (0.50) KMT2AKDM4EMEN1RECQLGAA
SCHEMBL688269 0.81 GAA (0.54) KMT2AKDM4EMEN1RECQLGAA
SCHEMBL20565454 0.81 PRSS1 (0.50) KMT2AMEN1RECQLLMNAMAPT
SCHEMBL4644742 0.79 GAA (0.48) KMT2AKDM4EMEN1RECQLGAA
SCHEMBL1246062 0.79 MEN1 (0.67) KMT2AKDM4EMEN1RECQLGAA

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
EP-2089440-B1 RADICALLY CURABLE COMPOSITION CONTAINING POLYMERIZABLE MONOMER AND RADICAL FORMER SIKA TECHNOLOGY AG (CH) 2013-12-18 — — EP claimed
US-20100028701-A1 Free-radically curable composition comprising polymerizable monomer and free-radical initiator SIKA TECHNOLOGY AG (CH) 2010-02-04 — — US disclosed
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