SCHEMBL13459280

COc1ccc(C(OC[C@H]2O[C@@H](n3cnc4c(NC(=O)C(C)C)ncnc43)C(OC(=S)N3CCS(=O)(=O)CC3)C2OP(OCCN)N(C(C)C)C(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	TYMP	P19971	5/20	0.39

▸	PRMT6	Q96LA8	1/20	0.34

▸	PRKAG1	P54619	2/20	0.34

▸	PRKAA1	Q13131	2/20	0.34

▸	PRKAB1	Q9Y478	2/20	0.34

▸	PRKAB2	O43741	1/20	0.34

▸	PRKAA2	P54646	1/20	0.34

▸	PRKAG3	Q9UGI9	1/20	0.34

▸	PRKAG2	Q9UGJ0	1/20	0.34

▸	P2RY12	Q9H244	1/20	0.33

▸	DOT1L	Q8TEK3	1/20	0.32

▸	ADORA1	P30542	1/20	0.32

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
SCHEMBL10457923	0.94	TYMP (0.38)	TYMPPRMT6PRKAG1PRKAA1PRKAB1
SCHEMBL10461189	0.94	TYMP (0.38)	TYMPPRMT6PRKAG1PRKAA1PRKAB1
SCHEMBL13838189	0.89	TYMP (0.38)	TYMPPRMT6PRKAG1PRKAA1PRKAB1
SCHEMBL13830723	0.89	TYMP (0.38)	TYMPPRMT6PRKAG1PRKAA1PRKAB1
SCHEMBL20346200	0.88	TYMP (0.38)	TYMPPRMT6PRKAG1PRKAA1PRKAB1
SCHEMBL10461147	0.87	TYMP (0.48)	TYMPPRKAG1PRKAA1PRKAB1P2RY12
SCHEMBL10459461	0.87	TYMP (0.48)	TYMPPRKAG1PRKAA1PRKAB1P2RY12
SCHEMBL10457830	0.85	TYMP (0.40)	TYMP
SCHEMBL31635532	0.85	TYMP (0.40)	TYMP
SCHEMBL13838198	0.85	TYMP (0.40)	TYMP

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
WO-2010034024-A2	PROTECTED MONOMERS AND METHODS OF DEPROTECTION FOR RNA SYNTHESIS	AGILENT TECHNOLOGIES, INC. (US)	2010-03-25	—	—	WO	disclosed