SCHEMBL7631015

SCHEMBL7631015

[CH2]CCCCCCCCCC[C](OOC(=O)c1ccc(C(C)(C)C)cc1)OOC(=O)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MAPT P10636 4/20 0.39
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HDAC1 Q13547 5/20 0.39
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
ALOX15 P16050 1/20 0.38
APEX1 P27695 1/20 0.38
MAPK1 P28482 1/20 0.38
RECQL P46063 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HDAC3 O15379 3/20 0.38
HDAC2 Q92769 2/20 0.38
TNF P01375 1/20 0.38
KLF5 Q13887 1/20 0.38
NOD1 Q9Y239 1/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL7632553 1.00 CA1 (0.40) CA1CA2NPSR1MAPTTDP1
SCHEMBL7636315 1.00 CA1 (0.40) CA1CA2NPSR1MAPTTDP1
SCHEMBL7635722 1.00 CA1 (0.40) CA1CA2NPSR1MAPTTDP1
SCHEMBL7630811 1.00 CA1 (0.40) CA1CA2NPSR1MAPTTDP1
SCHEMBL7625654 1.00 CA1 (0.40) CA1CA2NPSR1MAPTTDP1
SCHEMBL7628717 0.99 CA1 (0.41) CA1CA2NPSR1MAPTTDP1
SCHEMBL7628112 0.94 CA1 (0.42) CA1CA2NPSR1MAPTTDP1
SCHEMBL7631448 0.88 CA1 (0.43) CA1CA2NPSR1MAPTTDP1
SCHEMBL7634420 0.84 TDP1 (0.43) MAPTTDP1L3MBTL1HDAC1ALDH1A1
SCHEMBL7630202 0.84 TDP1 (0.43) MAPTTDP1L3MBTL1HDAC1ALDH1A1

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