SCHEMBL708248

SCHEMBL708248

Oc1cc(-c2ccc(C#Cc3ccccc3)cc2)cc(-c2ccc(C#Cc3ccccc3)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.53
ABL1 P00519 3/20 0.50
ABCB1 P08183 3/20 0.50
BCR P11274 3/20 0.50
APP P05067 1/20 0.50
CYP1A1 P04798 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP1B1 Q16678 1/20 0.47
ESR1 P03372 3/20 0.46
HNF4A P41235 1/20 0.46
MAPT P10636 1/20 0.45
MMP3 P08254 1/20 0.44
BCL2L1 Q07817 1/20 0.44
KCNH2 Q12809 1/20 0.43
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
HSD17B1 P14061 1/20 0.41
HSD17B2 P37059 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL2295150 0.89 APP (0.63) APPCYP1A1CYP1A2CYP1B1HNF4A
SCHEMBL21903459 0.82 ESR1 (0.70) ABL1ABCB1BCRAPPESR1
SCHEMBL10005583 0.82 EGFR (0.72) EGFRABL1ABCB1BCRESR1
SCHEMBL17616899 0.82 CA12 (0.57) ABL1ABCB1BCRAPPCYP1A2
SCHEMBL5949303 0.82 APP (0.75) APPCYP1A1CYP1A2CYP1B1MAPT
SCHEMBL28395598 0.80 MMP3 (0.71) APPCYP1A1CYP1A2CYP1B1ESR1
SCHEMBL19026498 0.80 APP (0.57) APPHNF4AMAPTFFAR1
SCHEMBL218214 0.79 EGFR (0.68) EGFRABL1ABCB1BCRESR1
SCHEMBL5886608 0.79 APP (0.71) APPCYP1A1CYP1A2CYP1B1MAPT
SCHEMBL4267409 0.78 APP (0.60) ABL1ABCB1BCRAPPCYP1A2

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 24 patents — showing the first 20. 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-9196289-B2 Method and device for high density data storage INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2015-11-24 US disclosed
EP-2351027-B1 METHOD AND DEVICE FOR HIGH DENSITY DATA STORAGE IBM (US) 2014-12-10 EP disclosed
US-20140301178-A1 METHOD AND DEVICE FOR HIGH DENSITY DATA STORAGE INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2014-10-09 US disclosed
US-8715804-B2 Method and device for high density data storage INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2014-05-06 US disclosed
US-8599673-B2 High density data storage medium, method and device INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-12-03 US disclosed
US-20120106314-A1 HIGH DENSITY DATA STORAGE MEDIUM, METHOD AND DEVICE INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-05-03 US disclosed
US-20120106314-A1 HIGH DENSITY DATA STORAGE MEDIUM, METHOD AND DEVICE INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-05-03 US disclosed
US-8125882-B2 High density data storage medium, method and device INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-02-28 US disclosed
US-20110128840-A1 HIGH DENSITY DATA STORAGE MEDIUM, METHOD AND DEVICE INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2011-06-02 US disclosed
US-7939620-B2 High density data storage medium, method and device INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2011-05-10 US disclosed
US-7939620-B2 High density data storage medium, method and device INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2011-05-10 US disclosed
WO-2010046814-A1 METHOD AND DEVICE FOR HIGH DENSITY DATA STORAGE INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2010-04-29 WO disclosed
US-7558186-B2 forming a layer of polyaryletherketone polymer crosslinked by cyclo-addition reaction of phenylethynyl group at the terminal ends, on a substrate, heat curing the crosslinked polymer, themomechanically writing, reading and erasing informations into resin layer INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2009-07-07 US disclosed
US-7558186-B2 forming a layer of polyaryletherketone polymer crosslinked by cyclo-addition reaction of phenylethynyl group at the terminal ends, on a substrate, heat curing the crosslinked polymer, themomechanically writing, reading and erasing informations into resin layer INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2009-07-07 US disclosed
US-20080175134-A1 HIGH DENSITY DATA STORAGE MEDIUM, METHOD AND DEVICE GLOBALFOUNDRIES U.S. INC. 2008-07-24 US disclosed
US-20080175134-A1 HIGH DENSITY DATA STORAGE MEDIUM, METHOD AND DEVICE GLOBALFOUNDRIES U.S. INC. 2008-07-24 US disclosed
US-20080161527-A1 HIGH DENSITY DATA STORAGE MEDIUM, METHOD AND DEVICE GLOBALFOUNDRIES U.S. INC. 2008-07-03 US disclosed
US-20080161527-A1 HIGH DENSITY DATA STORAGE MEDIUM, METHOD AND DEVICE GLOBALFOUNDRIES U.S. INC. 2008-07-03 US disclosed