SCHEMBL7628183

SCHEMBL7628183

[CH2]C[C](OOC(=O)c1ccc(CC)cc1)OOC(=O)c1ccc(CC)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
PLK1 P53350 1/20 0.46
TDP1 Q9NUW8 1/20 0.44
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
LMNA P02545 2/20 0.41
F2 P00734 1/20 0.41
LOXL2 Q9Y4K0 1/20 0.41
POLB P06746 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
LPL P06858 1/20 0.38
LIPG Q9Y5X9 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
ESR1 P03372 1/20 0.38

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
SCHEMBL7627598 0.88 THRB (0.50) ALDH1A1PLK1POLBKMT2ATAS1R3
SCHEMBL36204 0.87 ALDH1A1 (0.64) ALDH1A1PLK1TDP1RXRARXRB
SCHEMBL7623477 0.86 ALDH1A1 (0.47) ALDH1A1PLK1TDP1RXRARXRB
SCHEMBL7628480 0.85 THRA (0.53) ALDH1A1PLK1MEN1KMT2ACYP4A11
SCHEMBL7625120 0.84 THRB (0.54) ALDH1A1MEN1KMT2ACYP4A11
SCHEMBL7630917 0.84 TDP1 (0.52) ALDH1A1TDP1LMNAF2SMN1; SMN2
SCHEMBL7629904 0.83 ALDH1A1 (0.44) ALDH1A1PLK1TDP1RXRARXRB
SCHEMBL7627165 0.83 ALDH1A1 (0.44) ALDH1A1PLK1TDP1RXRARXRB
SCHEMBL7625754 0.83 THRA (0.55) ALDH1A1TDP1MEN1KMT2A
SCHEMBL7632222 0.82 ALDH1A1 (0.43) ALDH1A1PLK1TDP1RXRARXRB

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