SCHEMBL84247

SCHEMBL84247

Cc1ccc(Oc2cccc(Oc3ccc(N4C(=O)c5ccc(C#Cc6ccccc6)cc5C4=O)cc3)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.58
KMT2A Q03164 6/20 0.58
BRD4 O60885 1/20 0.56
HTT P42858 1/20 0.47
ALDH1A1 P00352 5/20 0.45
GAA P10253 1/20 0.45
MCHR1 Q99705 1/20 0.45
NPC1 O15118 1/20 0.44
TSHR P16473 1/20 0.44
CASP1 P29466 1/20 0.44
RAB9A P51151 1/20 0.44
CASP7 P55210 1/20 0.44
HSD17B10 Q99714 1/20 0.44
LPAR1 Q92633 2/20 0.44
LPAR3 Q9UBY5 2/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA9 Q16790 1/20 0.43
MAPT P10636 2/20 0.43
POLB P06746 2/20 0.43

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
SCHEMBL10000443 0.98 MEN1 (0.56) MEN1KMT2ABRD4HTTALDH1A1
SCHEMBL10000448 0.92 BRD4 (0.55) MEN1KMT2ABRD4HTTALDH1A1
SCHEMBL6400602 0.92 BRD4 (0.56) MEN1KMT2ABRD4HTTALDH1A1
SCHEMBL19689371 0.91 BRD4 (0.58) MEN1KMT2ABRD4HTTALDH1A1
SCHEMBL15695540 0.91 BRD4 (0.56) MEN1KMT2ABRD4HTTALDH1A1
SCHEMBL14259658 0.89 MEN1 (0.50) MEN1KMT2ABRD4HTTALDH1A1
SCHEMBL14438540 0.89 MEN1 (0.48) MEN1KMT2ABRD4HTTMCHR1
SCHEMBL29308141 0.88 BRD4 (0.56) MEN1KMT2ABRD4HTTALDH1A1
SCHEMBL20716046 0.88 ALDH1A1 (0.55) MEN1KMT2AALDH1A1NPC1TSHR
SCHEMBL12908006 0.87 MEN1 (0.49) MEN1KMT2ABRD4HTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8792318-B2 Method for high density data storage and imaging INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2014-07-29 US disclosed
US-8792318-B2 Method for high density data storage and imaging INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2014-07-29 US disclosed
US-20120155242-A1 METHOD FOR HIGH DENSITY DATA STORAGE AND IMAGING INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-06-21 US disclosed
US-8129496-B2 Method for high density data storage and imaging INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-03-06 US disclosed
US-20080219135-A1 METHOD FOR HIGH DENSITY DATA STORAGE AND IMAGING GLOBALFOUNDRIES U.S. INC. 2008-09-11 US disclosed