SCHEMBL14973252

SCHEMBL14973252

CC(C)(C)c1ccc2c(B(O)O)c3ccccc3c(B(O)O)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.47
ALDH1A1 P00352 3/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NPC1 O15118 1/20 0.38
PLA2G1B P04054 1/20 0.38
NFKB1 P19838 1/20 0.38
CASP3 P42574 1/20 0.38
RAB9A P51151 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
TRPV1 Q8NER1 4/20 0.37
PGR P06401 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
SCHEMBL3785185 0.94 ALDH1A1 (0.43) KIF11ALDH1A1HPGDALOX15HSD17B10
SCHEMBL29349699 0.86 KIF11 (0.40) KIF11ALDH1A1HPGDALOX15HSD17B10
SCHEMBL28682657 0.86 KIF11 (0.40) KIF11ALDH1A1HPGDALOX15HSD17B10
SCHEMBL2703284 0.79 TNKS (0.40) KIF11ALDH1A1NPC1RAB9ATRPV1
SCHEMBL2713835 0.78 ESR1 (0.38) KIF11MEN1GAAKMT2APOLB
SCHEMBL28384010 0.78 KIF11 (0.59) KIF11ALDH1A1HPGDALOX15HSD17B10
SCHEMBL24276292 0.77 KIF11 (0.44) KIF11ALDH1A1HPGDALOX15HSD17B10
SCHEMBL2246981 0.75 KIF11 (0.52) KIF11ALDH1A1HPGDALOX15HSD17B10
SCHEMBL11241576 0.75 KIF11 (0.52) KIF11ALDH1A1HPGDALOX15HSD17B10
SCHEMBL702357 0.74 ENPP2 (0.45) ALDH1A1HSD17B10TDP1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9343690-B2 Method for producing organic electroluminescence element, and organic electroluminescence element RICOH COMPANY, LTD. (JP) 2016-05-17 US disclosed
US-20130134360-A1 METHOD FOR PRODUCING ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ORGANIC ELECTROLUMINESCENCE ELEMENT RICOH COMPANY, LTD. (JP) 2013-05-30 US disclosed