SCHEMBL7631485

SCHEMBL7631485

[CH2]CCC[C](OOC(=O)c1ccc(OCCCCCC)cc1)OOC(=O)c1ccc(OCCCCCC)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.56
TSHR P16473 1/20 0.56
RARB P10826 3/20 0.56
PLA2G4B P0C869 6/20 0.55
THRA P10827 3/20 0.51
THRB P10828 3/20 0.51
NPC1 O15118 3/20 0.51
LMNA P02545 3/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
PLA2G4A P47712 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49

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
SCHEMBL7625635 0.96 TP53 (0.55) TP53TSHRRARBPLA2G4BTHRA
SCHEMBL7624198 0.96 TP53 (0.55) TP53TSHRRARBPLA2G4BTHRA
SCHEMBL7637035 0.96 TP53 (0.55) TP53TSHRRARBPLA2G4BTHRA
SCHEMBL7625837 0.96 RARB (0.49) TP53TSHRRARBPLA2G4BNPC1
SCHEMBL7631658 0.94 TP53 (0.57) TP53TSHRRARBPLA2G4BTHRA
SCHEMBL7624968 0.94 RARB (0.50) TP53TSHRRARBPLA2G4BTHRA
SCHEMBL7631281 0.94 RARB (0.50) TP53TSHRRARBPLA2G4BTHRA
SCHEMBL7633445 0.92 RARB (0.48) TP53TSHRRARBPLA2G4BNPC1
SCHEMBL7623890 0.92 L3MBTL1 (0.55) TP53TSHRRARBPLA2G4BTHRB
SCHEMBL7627715 0.90 L3MBTL1 (0.52) TP53TSHRRARBPLA2G4BTHRA

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