SCHEMBL2365653

COc1ccc(C(OC[C@H]2O[C@@H](n3cnc4c(=O)n(C(=O)C(C)C)c(N)nc43)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]2OP(OCCC#N)N(C(C)C)C(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	TYMP	P19971	15/20	0.42

▸	ADORA1	P30542	2/20	0.32

▸	CYP1A2	P05177	1/20	0.32

▸	NT5E	P21589	2/20	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.

Compound	similarity	top predicted	shared targets
SCHEMBL30140974	0.87	TYMP (0.40)	TYMPADORA1NT5E
SCHEMBL20691389	0.86	TYMP (0.57)	TYMPADORA1
SCHEMBL668541	0.86	TYMP (0.43)	TYMPADORA1NT5E
SCHEMBL29827283	0.85	TYMP (0.39)	TYMP
SCHEMBL30140968	0.85	TYMP (0.40)	TYMPADORA1NT5E
SCHEMBL24191301	0.84	ADORA1 (0.43)	TYMPADORA1NT5E
SCHEMBL21591932	0.84	TYMP (0.43)	TYMPADORA1NT5E
SCHEMBL21073923	0.84	TYMP (0.43)	TYMPADORA1NT5E
SCHEMBL18927167	0.84	TYMP (0.43)	TYMPADORA1NT5E
SCHEMBL19493308	0.84	TYMP (0.43)	TYMPADORA1NT5E

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-2365077-A1	iRNA agents targeting VEGF	Alnylam Pharmaceuticals, Inc. (US)	2011-09-14	—	—	EP	disclosed