SCHEMBL13633980

SCHEMBL13633980

COC(=O)CC(=O)Oc1ccc(C(C)(C)c2ccc(OC)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
LMNA P02545 3/20 0.51
ALDH1A1 P00352 3/20 0.51
HSD17B10 Q99714 2/20 0.51
MAPT P10636 2/20 0.51
HTT P42858 2/20 0.51
TDP1 Q9NUW8 2/20 0.50
ALOX15 P16050 1/20 0.50
APEX1 P27695 1/20 0.50
MAPK1 P28482 1/20 0.50
RECQL P46063 1/20 0.50
GAA P10253 3/20 0.46
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
MEN1 O00255 2/20 0.44
EPHX2 P34913 1/20 0.44
NR1H4 Q96RI1 1/20 0.44
L3MBTL1 Q9Y468 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
SCHEMBL12722242 0.89 LMNA (0.50) KMT2ALMNAALDH1A1HSD17B10MAPT
SCHEMBL10001296 0.89 LMNA (0.49) KMT2ALMNAALDH1A1HSD17B10MAPT
SCHEMBL12761952 0.88 MAPT (0.47) KMT2ALMNAALDH1A1HSD17B10MAPT
SCHEMBL5130508 0.84 HTT (0.63) KMT2ALMNAALDH1A1HSD17B10MAPT
SCHEMBL18969717 0.83 LMNA (0.49) KMT2ALMNAALDH1A1HSD17B10MAPT
SCHEMBL2703212 0.81 ALDH1A1 (0.47) KMT2ALMNAALDH1A1HSD17B10MAPT
SCHEMBL3424216 0.81 MAPT (0.51) KMT2ALMNAALDH1A1HSD17B10MAPT
SCHEMBL16093179 0.81 KMT2A (0.53) KMT2ALMNAALDH1A1HSD17B10MAPT
SCHEMBL12227849 0.81 ALDH1A1 (0.66) KMT2ALMNAALDH1A1HSD17B10MAPT
SCHEMBL677362 0.80 LMNA (0.47) KMT2ALMNAALDH1A1HSD17B10MAPT

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
US-8304747-B2 Sensors and methods for determining whether an item has been exposed to an environmental condition XEROX CORPORATION (US) 2012-11-06 US disclosed