SCHEMBL7625631

SCHEMBL7625631

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.42
THRB P10828 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
NR2F2 P24468 1/20 0.40
PAX8 Q06710 1/20 0.40
KLF5 Q13887 1/20 0.40
ALDH1A1 P00352 4/20 0.38
POLB P06746 3/20 0.38
CTDSP1 Q9GZU7 3/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
CYP4A11 Q02928 3/20 0.37
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL7628086 0.92 RARB (0.44) PLK1THRBALDH1A1NPC1RAB9A
SCHEMBL7631079 0.91 THRA (0.47) THRBALDH1A1KMT2AMAPTCYP4A11
SCHEMBL7637287 0.90 ALDH1A1 (0.43) PLK1L3MBTL1ALDH1A1POLBNPC1
SCHEMBL7626724 0.90 THRA (0.49) THRBALDH1A1KMT2AMAPTTDP1
SCHEMBL7633700 0.84 PLK1 (0.45) PLK1THRBL3MBTL1NR2F2PAX8
SCHEMBL7636911 0.82 TDP1 (0.44) ALDH1A1GAANPC1RAB9AKMT2A
SCHEMBL7634659 0.82 PLK1 (0.49) PLK1THRBL3MBTL1NR2F2PAX8
SCHEMBL7623941 0.81 CA1 (0.46) L3MBTL1KLF5ALDH1A1NPC1RAB9A
SCHEMBL7624126 0.81 TDP1 (0.57) L3MBTL1ALDH1A1KDM4EGAANPC1
SCHEMBL7630626 0.80 CA1 (0.49) ALDH1A1KDM4EKMT2AMAPTESR2

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