SCHEMBL5502099

CC[C@H](C)CC1(C[C@@H](C)CC)c2ccccc2-c2ccc(-c3ccc4c(c3)C(C[C@@H](C)CC)(C[C@@H](C)CC)c3cc(B(O)O)ccc3-4)cc21

nearest known ligand 0.34

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	PDK2	Q15119	18/20	0.34

▸	MGLL	Q99685	2/20	0.32

▸	CA1	P00915	1/20	0.31

▸	CA2	P00918	1/20	0.31

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.

Compound	similarity	top predicted	shared targets
SCHEMBL5497590	1.00	PDK2 (0.34)	PDK2MGLLCA1CA2
SCHEMBL5497942	0.95	PDK2 (0.34)	PDK2CA1CA2
SCHEMBL5502876	0.95	PDK2 (0.34)	PDK2CA1CA2
SCHEMBL4363141	0.82	APEX1 (0.35)	PDK2
SCHEMBL5500164	0.82	APEX1 (0.38)	PDK2MGLLCA1CA2
SCHEMBL5502638	0.81	PDK2 (0.40)	PDK2
SCHEMBL5502237	0.81	PDK2 (0.40)	PDK2
SCHEMBL5499014	0.81	PDK2 (0.40)	PDK2
SCHEMBL5496894	0.81	PDK2 (0.40)	PDK2
SCHEMBL5503913	0.79	—	—

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-1425168-A4	LIGHT-EMITTING ORGANIC OLIGOMER COMPOSITIONS	UNIV ROCHESTER (US)	2007-01-03	—	—	EP	disclosed
US-7057009-B2	Crosslinking polyfluorene; molecular orientation	UNIVERSITY OF ROCHESTER (US)	2006-06-06	—	—	US	disclosed
EP-1425168-A2	LIGHT-EMITTING ORGANIC OLIGOMER COMPOSITIONS	University of Rochester (US)	2004-06-09	—	—	EP	disclosed
US-20030039838-A1	Light-emitting organic oligomer compositions	UNIVERSITY OF ROCHESTER	2003-02-27	—	—	US	disclosed
WO-2003008475-A2	LIGHT-EMITTING ORGANIC OLIGOMER COMPOSITIONS	UNIVERSITY OF ROCHESTER (US)	2003-01-30	—	—	WO	disclosed