SCHEMBL84238

SCHEMBL84238

O=C1c2ccc(C#Cc3ccccc3)cc2C(=O)N1CN1C(=O)c2ccc(Cc3ccc4c(c3)C(=O)N(CN3C(=O)c5ccc(C#Cc6ccccc6)cc5C3=O)C4=O)cc2C1=O

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 15/20 0.58
FFAR1 O14842 1/20 0.40
ASIC3 Q9UHC3 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
MEN1 O00255 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
MMP2 P08253 1/20 0.38
MMP9 P14780 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
SCHEMBL14326160 0.91 GRM5 (0.63) GRM5MEN1HPGDKMT2AMMP2
SCHEMBL84480 0.89 GRM5 (0.56) GRM5FFAR1MMP2MMP9
SCHEMBL84290 0.83 GRM5 (0.55) GRM5HPGDMMP2MMP9
SCHEMBL23425551 0.81 GRM5 (0.62) GRM5HDAC3HDAC4HDAC1HDAC7
SCHEMBL504644 0.80 GRM5 (0.60) GRM5MEN1KMT2AMMP2MMP9
SCHEMBL10000438 0.79 GRM5 (0.52) GRM5MEN1KMT2AMMP2MMP9
SCHEMBL16927148 0.78 GRM5 (0.66) GRM5
SCHEMBL13703631 0.76 GRM5 (0.48) GRM5MEN1HPGDKMT2A
SCHEMBL10000440 0.76 POLB (0.44) GRM5MEN1HPGDKMT2AMMP2
SCHEMBL25446896 0.74 MGLL (0.42) HDAC3HDAC4HDAC1HDAC7HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9676890-B2 Method and device for high density data storage INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2017-06-13 US disclosed
US-20160039965-A1 METHOD AND DEVICE FOR HIGH DENSITY DATA STORAGE INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2016-02-11 US disclosed
US-9255182-B2 Data storage medium and method for high density data storage INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2016-02-09 US disclosed
US-9196289-B2 Method and device for high density data storage INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2015-11-24 US disclosed
US-20140301178-A1 METHOD AND DEVICE FOR HIGH DENSITY DATA STORAGE INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2014-10-09 US disclosed
US-8792318-B2 Method for high density data storage and imaging INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2014-07-29 US disclosed
US-8369204-B2 Method for high density data storage and imaging INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-02-05 US disclosed
US-8289833-B2 Method for high density data storage and imaging INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-10-16 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-20120033539-A1 METHOD FOR HIGH DENSITY DATA STORAGE AND IMAGING INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-02-09 US disclosed
US-20120034383-A1 METHOD FOR HIGH DENSITY DATA STORAGE AND IMAGING INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-02-09 US disclosed
US-8102753-B2 Method for forming deformed regions in a resin layer INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-01-24 US disclosed
US-20110199887-A1 METHOD AND DEVICE FOR HIGH DENSITY DATA STORAGE INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2011-08-18 US disclosed
US-20080076903-A1 DATA STORAGE MEDIUM AND METHOD FOR HIGH DENSITY DATA STORAGE INTERNATIONAL BUSINESS MACHINES CORPORATION 2008-03-27 US disclosed
US-20070195682-A1 METHOD FOR HIGH DENSITY DATA STORAGE AND IMAGING GLOBALFOUNDRIES INC. (KY) 2007-08-23 US disclosed