SCHEMBL19723627

Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(C(=O)c3ccc4c(c3)C3(c5ccccc5-4)c4cc(-n5c6ccccc6c6ccccc65)ccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc43)ccc1-2

nearest known ligand 0.41

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	LMNA	P02545	1/20	0.41

▸	MAPT	P10636	1/20	0.41

▸	HTT	P42858	1/20	0.41

▸	PDK2	Q15119	10/20	0.39

▸	RORC	P51449	1/20	0.35

▸	CNR2	P34972	2/20	0.34

▸	AKR1C4	P17516	1/20	0.33

▸	AKR1C3	P42330	1/20	0.33

▸	AKR1C2	P52895	1/20	0.33

▸	AKR1C1	Q04828	1/20	0.33

▸	HDAC6	Q9UBN7	2/20	0.33

▸	CA12	O43570	1/20	0.33

▸	CA1	P00915	1/20	0.33

▸	CA9	Q16790	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.

Compound	similarity	top predicted	shared targets
SCHEMBL364863	0.93	PDK2 (0.43)	LMNAMAPTHTTPDK2RORC
SCHEMBL13781104	0.93	PDK2 (0.43)	LMNAMAPTHTTPDK2RORC
SCHEMBL13781064	0.92	PDK2 (0.39)	LMNAMAPTHTTPDK2CNR2
SCHEMBL15159127	0.90	LMNA (0.36)	LMNAMAPTHTTPDK2RORC
SCHEMBL13781093	0.90	PDK2 (0.49)	LMNAMAPTPDK2RORCCNR2
SCHEMBL13781028	0.90	PDK2 (0.49)	LMNAMAPTPDK2RORCCNR2
SCHEMBL13781092	0.89	PDK2 (0.39)	LMNAMAPTHTTPDK2RORC
SCHEMBL13781057	0.88	PDK2 (0.46)	LMNAMAPTHTTPDK2RORC
SCHEMBL13781091	0.88	PDK2 (0.39)	LMNAMAPTHTTPDK2RORC
SCHEMBL12699647	0.87	LMNA (0.32)	LMNAMAPTHTTPDK2

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-2627732-B1	MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES	MERCK PATENT GMBH (DE)	2017-12-20	—	—	EP	disclosed