SCHEMBL19987378

CC(C)OC(=O)[C@H](C)NP(=O)(OC[C@H]1C2(C)O[C@@H](n3cnc4c(NCc5ccccc5)ncnc43)C(F)C12COP(=O)(N[C@@H](C)C(=O)OC(C)C)Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	DNPH1	O43598	1/20	0.44

▸	NT5E	P21589	1/20	0.43

▸	P2RX3	P56373	1/20	0.42

▸	P2RX2	Q9UBL9	1/20	0.42

▸	ADORA3	P0DMS8	7/20	0.41

▸	CYP3A4	P08684	2/20	0.41

▸	CYP2C9	P11712	2/20	0.41

▸	TSHR	P16473	1/20	0.40

▸	TP53	P04637	1/20	0.39

▸	SLC29A1	Q99808	1/20	0.39

▸	TDP1	Q9NUW8	1/20	0.39

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
SCHEMBL19987348	0.91	NT5E (0.47)	NT5E
SCHEMBL19987194	0.89	CYP3A4 (0.43)	DNPH1CYP3A4CYP2C9
SCHEMBL19987160	0.87	DNPH1 (0.46)	DNPH1NT5EP2RX3P2RX2ADORA3
SCHEMBL19987349	0.87	CYP3A4 (0.44)	DNPH1NT5EP2RX3P2RX2ADORA3
SCHEMBL19987204	0.86	NT5E (0.47)	NT5E
SCHEMBL19987270	0.85	NT5E (0.45)	NT5E
SCHEMBL19987299	0.84	CYP3A4 (0.43)	DNPH1CYP3A4CYP2C9
SCHEMBL19987311	0.84	CYP3A4 (0.46)	DNPH1NT5EP2RX3P2RX2ADORA3
SCHEMBL19987201	0.83	CYP3A4 (0.42)	NT5EP2RX3P2RX2CYP3A4CYP2C9
SCHEMBL19987193	0.83	CYP3A4 (0.42)	NT5ECYP3A4CYP2C9

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-2018049535-A1	NUCLEOSIDE ANALOGUES AND METHODS OF USE THEREOF	LCB PHARMA INC. (CA)	2018-03-22	—	—	WO	disclosed