SCHEMBL7634073

SCHEMBL7634073

Cc1cc(C)c(C(=O)OOC(=O)OCC(C)(COC(=O)OOC(=O)c2c(C)cc(C)cc2C)COC(=O)OOC(=O)c2c(C)cc(C)cc2C)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP3A4 P08684 3/20 0.34
TDP1 Q9NUW8 1/20 0.34
LMNA P02545 3/20 0.33
CYP2C19 P33261 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HPGD P15428 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NLRP3 Q96P20 1/20 0.31
SERPINE1 P05121 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
SCHEMBL7625717 0.89 ELANE (0.36) ELANEL3MBTL1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL7625852 0.85 L3MBTL1 (0.37) ELANEL3MBTL1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL7630962 0.84 CA12 (0.38) ELANEL3MBTL1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL7636360 0.83 SERPINE1 (0.38) L3MBTL1CYP3A4TDP1LMNACYP2C19
SCHEMBL7631687 0.82 L3MBTL1 (0.35) ELANEL3MBTL1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL7632278 0.80 KMT2A (0.31) LMNAKMT2A
SCHEMBL125935 0.79 CYP3A4 (0.41) L3MBTL1KDM4ESMN1; SMN2ALDH1A1CYP3A4
SCHEMBL7631684 0.78 ALDH1A1 (0.40) ELANEL3MBTL1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL7625039 0.78 MEN1 (0.43) L3MBTL1KDM4ESMN1; SMN2ALDH1A1TDP1
SCHEMBL7631679 0.77 ESR1 (0.48) ELANEL3MBTL1SMN1; SMN2CYP3A4TDP1

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