SCHEMBL7636618

SCHEMBL7636618

CCCCCC[C](C)OOC(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
SMN1; SMN2 Q16637 4/20 0.49
HPGD P15428 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
CES2 O00748 2/20 0.47
CES1 P23141 2/20 0.47
RARB P10826 7/20 0.46
GAA P10253 1/20 0.45
HDAC3 O15379 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
NCOR2 Q9Y618 1/20 0.45
MAPT P10636 3/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
RARA P10276 1/20 0.44
MTOR P42345 1/20 0.44
KMT2A Q03164 1/20 0.44
PDCD1 Q15116 1/20 0.44

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
SCHEMBL7625349 0.91 CES2 (0.55) L3MBTL1CES2CES1MAPTMEN1
SCHEMBL7633233 0.88 PTPN11 (0.47) POLBCES2CES1HDAC1HDAC2
SCHEMBL7628403 0.84 HSD17B3 (0.44) RARBMAPTMEN1ALDH1A1RARA
SCHEMBL7625804 0.84 L3MBTL1 (0.48) SMN1; SMN2L3MBTL1CES2CES1GAA
SCHEMBL7632824 0.82 MAPT (0.56) SMN1; SMN2HPGDL3MBTL1MAPTALDH1A1
SCHEMBL7633787 0.82 THRA (0.55) RARBMAPTMEN1ALDH1A1RARA
SCHEMBL7633838 0.82 THRA (0.48) L3MBTL1RARBMAPTMEN1ALDH1A1
SCHEMBL7625770 0.82 THRA (0.55) RARBMAPTMEN1ALDH1A1RARA
SCHEMBL7625706 0.82 THRA (0.51) RARBMAPTMEN1ALDH1A1RARA
SCHEMBL7631122 0.82 CA1 (0.47) HDAC3HDAC1HDAC2HDAC8ALDH1A1

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