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SCHEMBL7627685

SCHEMBL7627685

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

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ CYP3A4 P08684 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ ELANE P08246 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL7632061 0.93 ALDH1A1 (0.31) SMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL7625735 0.93 ALDH1A1 (0.31) SMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL7632205 0.86 CA12 (0.34) ALDH1A1L3MBTL1TDP1ELANE
SCHEMBL7633626 0.84 KMT2A (0.36) ALDH1A1L3MBTL1TDP1MEN1KMT2A
SCHEMBL7628011 0.83 TAS1R3 (0.41) SMN1; SMN2L3MBTL1TDP1LMNAMEN1
SCHEMBL7631684 0.82 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1L3MBTL1CYP3A4TDP1
SCHEMBL7623937 0.80 CA12 (0.32) TDP1ELANE
SCHEMBL7635429 0.80 MEN1 (0.40) SMN1; SMN2ALDH1A1L3MBTL1TDP1LMNA
SCHEMBL7625414 0.80 CA12 (0.32) ALDH1A1TDP1ELANE
SCHEMBL7631414 0.79 ADRB2 (0.42) ALDH1A1TDP1MEN1KMT2A

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