SCHEMBL3793142

COc1ccc(C(O[C@]2(F)[C@H](O)[C@@H](CO)O[C@]2(n2ccc(N)nc2=O)C(c2ccccc2)(c2ccccc2)c2ccc(OC)cc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	PDE4D	Q08499	1/20	0.37

▸	PDE3A	Q14432	1/20	0.37

▸	SLC29A1	Q99808	1/20	0.37

▸	LMNA	P02545	1/20	0.33

▸	THRB	P10828	1/20	0.33

▸	MTOR	P42345	1/20	0.33

▸	MDM2	Q00987	1/20	0.33

▸	NCOA1	Q15788	1/20	0.33

▸	NCOA3	Q9Y6Q9	1/20	0.33

▸	TYMP	P19971	1/20	0.33

▸	BACE1	P56817	2/20	0.30

▸	BACE2	Q9Y5Z0	1/20	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
SCHEMBL384130	0.89	PDE4D (0.39)	PDE4DPDE3ASLC29A1LMNATHRB
SCHEMBL9083312	0.80	PDE3A (0.39)	PDE4DPDE3ASLC29A1LMNATHRB
SCHEMBL23648799	0.78	PDE3A (0.36)	PDE4DPDE3ASLC29A1LMNATHRB
SCHEMBL383850	0.76	L3MBTL1 (0.31)	PDE4DPDE3ASLC29A1TYMPBACE1
SCHEMBL1739169	0.74	PDE3A (0.32)	PDE4DPDE3ASLC29A1LMNATHRB
SCHEMBL3789736	0.74	NT5E (0.31)	LMNATHRBMTORMDM2NCOA1
SCHEMBL29834201	0.72	P2RY14 (0.34)	SLC29A1TYMP
SCHEMBL28862842	0.71	PDE4D (0.30)	PDE4DPDE3ASLC29A1LMNATHRB
SCHEMBL30514382	0.70	TYMP (0.42)	TYMPBACE1
SCHEMBL28569717	0.70	PDE3A (0.53)	PDE4DPDE3ASLC29A1LMNATHRB

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