SCHEMBL15947786

SCHEMBL15947786

CC1(C)c2cc(C(F)(F)F)ccc2-c2cc3ccc4c5c(cc6ccc1c2c6c35)-c1ccc(C(F)(F)F)cc1C4(C)C

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 1/20 0.34
BACE1 P56817 1/20 0.31
GPR3 P46089 1/20 0.31
KDM4E B2RXH2 1/20 0.31
METAP2 P50579 1/20 0.31
ALK Q9UM73 2/20 0.31
PDE2A O00408 1/20 0.31
MPL P40238 1/20 0.30
PNMT P11086 1/20 0.30

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
SCHEMBL15945815 0.93 PDK2 (0.37) TDP2ALK
SCHEMBL13324397 0.82 GPR3 (0.41) TDP2GPR3
SCHEMBL15947785 0.78 CYP11B2 (0.34) TDP2BACE1ALKPDE2AMPL
SCHEMBL15945840 0.73 PDK2 (0.35) ALKMPL
SCHEMBL20779077 0.73 PARP1 (0.40) TDP2GPR3PDE2A
SCHEMBL13911443 0.72 PGR (0.34) KDM4EALK
SCHEMBL15945836 0.70 PDK2 (0.44)
SCHEMBL15197367 0.70 PDK2 (0.34) KDM4E
SCHEMBL10025090 0.69 PDK2 (0.40) TDP2
SCHEMBL16153248 0.68 PDK2 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11177450-B2 Organoelectroluminescent element, and light emission device, display device, and illumination device in which said organoelectroluminescent element is used UDC IRELAND LIMITED (IE) 2021-11-16 US disclosed
US-9608207-B2 Organic electroluminescence element UDC IRELAND LIMITED (IE) 2017-03-28 US disclosed
US-20140299851-A1 Organic Electroluminescence Element UDC IRELAND LIMITED (IE) 2014-10-09 US disclosed
US-20140225085-A1 Organoelectroluminescent Element, and Light Emission Device, Display Device, and Illumination Device in which Said Organoelectroluminescent Element is Used UDC IRELAND LIMITED (IE) 2014-08-14 US disclosed