SCHEMBL7630708

SCHEMBL7630708

CCCCc1ccc(C(=O)OO[C]2CCC(CC)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.43
PLK1 P53350 1/20 0.43
THRA P10827 3/20 0.42
THRB P10828 3/20 0.42
CYP4A11 Q02928 2/20 0.40
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP4F2 P78329 1/20 0.39
MGLL Q99685 1/20 0.39
TRPV1 Q8NER1 1/20 0.39

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
SCHEMBL7634238 0.96 THRA (0.45) RARBTHRATHRBALDH1A1
SCHEMBL7628075 0.95 THRA (0.47) RARBTHRATHRBALDH1A1
SCHEMBL7633912 0.92 PLK1 (0.40) PLK1THRBCYP4A11ALDH1A1MGLL
SCHEMBL7625785 0.91 RARB (0.42) RARBPLK1THRATHRBCYP4A11
SCHEMBL7633239 0.89 RARB (0.43) RARBPLK1THRATHRBCYP4A11
SCHEMBL7625553 0.88 MEN1 (0.42) PLK1DDB1CRBNALDH1A1HPGD
SCHEMBL7624315 0.88 THRA (0.44) RARBTHRATHRBALDH1A1
SCHEMBL7625897 0.87 THRA (0.46) RARBTHRATHRBALDH1A1
SCHEMBL7636996 0.87 RARB (0.49) RARBPLK1THRATHRBCYP4A11
SCHEMBL7629434 0.86 PLK1 (0.38) RARBPLK1THRATHRBCYP4A11

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