SCHEMBL7633700

SCHEMBL7633700

CCCc1ccc(C(=O)OO[C](C)COC)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.45
THRB P10828 2/20 0.44
CYP4A11 Q02928 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CYP4F2 P78329 2/20 0.42
ALDH1A1 P00352 3/20 0.41
POLB P06746 2/20 0.41
CTDSP1 Q9GZU7 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.40
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
MAPT P10636 2/20 0.40
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
KMT2A Q03164 1/20 0.40
NR2F2 P24468 1/20 0.40
PAX8 Q06710 1/20 0.40
KLF5 Q13887 1/20 0.40

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
SCHEMBL7631807 0.91 RARB (0.48) PLK1THRBCYP4A11CYP4F2ALDH1A1
SCHEMBL7634780 0.89 ALDH1A1 (0.47) PLK1CYP4A11CYP4F2ALDH1A1POLB
SCHEMBL7634659 0.86 PLK1 (0.49) PLK1THRBCYP4A11L3MBTL1CYP4F2
SCHEMBL7625631 0.84 PLK1 (0.42) PLK1THRBCYP4A11L3MBTL1CYP4F2
SCHEMBL7628219 0.82 PLK1 (0.51) PLK1THRBCYP4A11L3MBTL1CYP4F2
SCHEMBL7632802 0.81 TDP1 (0.53) ALDH1A1GAARAB9ANPC1MAPT
SCHEMBL7627894 0.80 CA1 (0.55) L3MBTL1KDM4ERAB9ANPC1MAPT
SCHEMBL7633838 0.79 THRA (0.48) THRBL3MBTL1ALDH1A1MAPTKMT2A
SCHEMBL7627706 0.79 MAPT (0.51) PLK1THRBL3MBTL1KDM4EGAA
SCHEMBL7628440 0.79 MAPT (0.51) L3MBTL1GAANPC1MAPTKMT2A

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