SCHEMBL4781593

SCHEMBL4781593

C/C=C/C(=O)OC1CCCCC1OC(=O)/C=C/C

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.37
SERPINE1 P05121 2/20 0.35
EDNRA P25101 3/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
GSTP1 P09211 1/20 0.33

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
SCHEMBL4781594 1.00 ATM (0.37) ATMSERPINE1EDNRAMEN1KMT2A
SCHEMBL4625976 0.98 ATM (0.36) ATMSERPINE1EDNRAMEN1KMT2A
SCHEMBL17686485 0.91 ATM (0.39) ATMEDNRAGSTP1
SCHEMBL19275518 0.88 CYP19A1 (0.41) ATMMEN1KMT2AGSTP1
SCHEMBL3188398 0.86 EDNRA (0.46) ATMSERPINE1EDNRAMEN1KMT2A
SCHEMBL3188408 0.86 EDNRA (0.46) ATMSERPINE1EDNRAMEN1KMT2A
SCHEMBL272494 0.84 ATM (0.34) ATMMEN1KMT2A
SCHEMBL272495 0.84 ATM (0.34) ATMMEN1KMT2A
SCHEMBL21061286 0.84 ATM (0.34) ATMMEN1KMT2A
SCHEMBL19244485 0.83 EPHX1 (0.41) EDNRAGSTP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008004788-A1 NOVEL DERIVATIVES OF CYCLIC COMPOUND AND THE USE THEREOF WONKISOPHARM CO., LTD. (KR) 2008-01-10 WO claimed
US-8778568-B2 Optical data storage media and methods for using the same GENERAL ELECTRIC COMPANY (US) 2014-07-15 US disclosed
US-8507153-B2 Compositions, optical data storage media and methods for using the optical data storage media GENERAL ELECTRIC COMPANY (US) 2013-08-13 US disclosed
US-8420853-B2 Derivatives of cyclic compound and the use thereof Wonkisopharm Co., Ltd (KR) 2013-04-16 US disclosed
US-8343608-B2 Use of appended dyes in optical data storage media GENERAL ELECTRIC COMPANY (US) 2013-01-01 US disclosed
US-20120147724-A1 OPTICAL DATA STORAGE MEDIA AND METHODS FOR USING THE SAME GENERAL ELECTRIC COMPANY (US) 2012-06-14 US disclosed
US-20120052232-A1 USE OF APPENDED DYES IN OPTICAL DATA STORAGE MEDIA GENERAL ELECTRIC COMPANY (US) 2012-03-01 US disclosed
US-8124299-B2 Methods for using optical data storage media GENERAL ELECTRIC COMPANY (US) 2012-02-28 US disclosed
US-20110053054-A1 COMPOSITIONS, OPTICAL DATA STORAGE MEDIA AND METHODS FOR USING THE OPTICAL DATA STORAGE MEDIA GENERAL ELECTRIC COMPANY (US) 2011-03-03 US disclosed
US-20110053055-A1 COMPOSITIONS, OPTICAL DATA STORAGE MEDIA AND METHODS FOR USING THE OPTICAL DATA STORAGE MEDIA GENERAL ELECTRIC COMPANY (US) 2011-03-03 US disclosed