SCHEMBL7630449

SCHEMBL7630449

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HDAC1 Q13547 1/20 0.50
SRD5A2 P31213 1/20 0.48
TNF P01375 1/20 0.47
KLF5 Q13887 1/20 0.47
NOD1 Q9Y239 1/20 0.47
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
PRSS1 P07477 1/20 0.45
ACR P10323 1/20 0.45
ALDH1A1 P00352 3/20 0.45
HSD17B10 Q99714 2/20 0.45
LMNA P02545 1/20 0.45
ALOX15 P16050 1/20 0.45
APEX1 P27695 1/20 0.45
MAPK1 P28482 1/20 0.45
RECQL P46063 1/20 0.45
MEN1 O00255 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
SCHEMBL5987317 0.88 HDAC1 (0.57) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL10634213 0.86 HDAC1 (0.55) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL6887638 0.84 HDAC1 (0.53) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL7627465 0.83 HDAC1 (0.53) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL9878491 0.81 TDP1 (0.69) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL11423325 0.81 TDP1 (0.67) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL7624106 0.81 MAPT (0.50) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL7635028 0.80 CA1 (0.47) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL7633843 0.80 MAPT (0.46) MAPTTDP1L3MBTL1HDAC1SRD5A2
SCHEMBL446399 0.79 HDAC1 (0.57) MAPTTDP1L3MBTL1HDAC1SRD5A2

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