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SCHEMBL7632061

SCHEMBL7632061

Cc1cc(C)c(C(=O)OOC(=O)OCCC(COC(=O)OOC(=O)c2c(C)cc(C)cc2C)C(COC(=O)OOC(=O)c2c(C)cc(C)cc2C)C(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 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ L3MBTL1 Q9Y468 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
SCHEMBL7625735 0.97 ALDH1A1 (0.31) ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL7627685 0.93 SMN1; SMN2 (0.33) ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL7625414 0.87 CA12 (0.32) ALDH1A1
SCHEMBL7624255 0.86 KMT2A (0.36) ALDH1A1L3MBTL1
SCHEMBL7623937 0.85 CA12 (0.32) —
SCHEMBL7633096 0.84 TAS1R3 (0.39) SMN1; SMN2L3MBTL1
SCHEMBL7627960 0.83 KMT2A (0.36) ALDH1A1L3MBTL1
SCHEMBL7635370 0.81 TAS1R3 (0.39) SMN1; SMN2L3MBTL1
SCHEMBL7624856 0.81 KMT2A (0.38) ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL7634823 0.81 ADRB2 (0.39) ALDH1A1L3MBTL1

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