SCHEMBL3784562

COc1ccc(C(Nc2ccn([C@@H]3O[C@H](C(C)OC(c4ccccc4)(c4ccccc4)c4ccc(OC)cc4)[C@@H](O)[C@H]3O)c(=O)n2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	TYMP	P19971	1/20	0.40

▸	P2RY6	Q15077	11/20	0.37

▸	P2RY14	Q15391	2/20	0.37

▸	NT5E	P21589	2/20	0.37

▸	P2RY2	P41231	8/20	0.37

▸	P2RY4	P51582	7/20	0.37

▸	ST6GAL1	P15907	1/20	0.35

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
SCHEMBL17223111	0.84	P2RY6 (0.38)	TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL13253110	0.83	P2RY6 (0.45)	TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL13134727	0.82	TYMP (0.34)	TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL13134668	0.82	TYMP (0.34)	TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL800905	0.82	P2RY6 (0.33)	TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL11996482	0.82	TYMP (0.59)	TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL800270	0.82	P2RY6 (0.33)	TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL800718	0.82	TYMP (0.34)	TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL800303	0.82	TYMP (0.34)	TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL18720689	0.81	LMNA (0.52)	TYMPP2RY6P2RY14NT5EP2RY2

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-2010108140-A1	SUBSTITUTED NUCLEOSIDE AND NUCLEOTIDE ANALOGS	ALIOS BIOPHARMA, INC. (US)	2010-09-23	—	—	WO	disclosed