SCHEMBL7623926

SCHEMBL7623926

CCCCc1ccc(C(=O)OO[C](C)CC)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RARB P10826 6/20 0.51
PLK1 P53350 1/20 0.51
THRA P10827 4/20 0.50
THRB P10828 4/20 0.50
TRPV1 Q8NER1 1/20 0.49
POLB P06746 1/20 0.48
CYP4A11 Q02928 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CYP4F2 P78329 1/20 0.46
MEN1 O00255 1/20 0.45
RARA P10276 1/20 0.45
MAPT P10636 1/20 0.45
MTOR P42345 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL7637077 0.95 THRA (0.54) RARBTHRATHRBCYP4A11ALDH1A1
SCHEMBL7627402 0.94 THRA (0.56) RARBTHRATHRBALDH1A1MEN1
SCHEMBL7634659 0.90 PLK1 (0.49) PLK1THRATHRBTRPV1POLB
SCHEMBL7131124 0.90 RARB (0.61) RARBPLK1THRATHRBTRPV1
SCHEMBL7631293 0.87 RARB (0.54) RARBPLK1THRATHRBTRPV1
SCHEMBL7631807 0.87 RARB (0.48) RARBPLK1THRATHRBTRPV1
SCHEMBL7625706 0.87 THRA (0.51) RARBPLK1THRATHRBALDH1A1
SCHEMBL7635273 0.85 ALDH1A1 (0.52) PLK1POLBALDH1A1HPGDMEN1
SCHEMBL7633787 0.84 THRA (0.55) RARBTHRATHRBALDH1A1MEN1
SCHEMBL7625770 0.84 THRA (0.55) RARBTHRATHRBALDH1A1MEN1

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