SCHEMBL19987349

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

nearest known ligand 0.44

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	CYP3A4	P08684	2/20	0.44

▸	CYP2C9	P11712	2/20	0.44

▸	ADORA3	P0DMS8	4/20	0.42

▸	DNPH1	O43598	1/20	0.41

▸	NT5E	P21589	1/20	0.40

▸	P2RX3	P56373	1/20	0.39

▸	P2RX2	Q9UBL9	1/20	0.39

▸	TSHR	P16473	1/20	0.38

▸	BTN3A1	O00481	1/20	0.38

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
SCHEMBL19987311	0.87	CYP3A4 (0.46)	CYP3A4CYP2C9ADORA3DNPH1NT5E
SCHEMBL19987378	0.87	DNPH1 (0.44)	CYP3A4CYP2C9ADORA3DNPH1NT5E
SCHEMBL21511261	0.84	CYP3A4 (0.46)	CYP3A4CYP2C9ADORA3BTN3A1
SCHEMBL19987319	0.84	CYP3A4 (0.42)	CYP3A4CYP2C9ADORA3DNPH1NT5E
SCHEMBL19987160	0.82	DNPH1 (0.46)	CYP3A4CYP2C9ADORA3DNPH1NT5E
SCHEMBL26025460	0.80	CYP3A4 (0.62)	CYP3A4CYP2C9ADORA3DNPH1NT5E
SCHEMBL26025461	0.80	CYP3A4 (0.62)	CYP3A4CYP2C9ADORA3DNPH1NT5E
SCHEMBL26025459	0.80	CYP3A4 (0.62)	CYP3A4CYP2C9ADORA3DNPH1NT5E
SCHEMBL26029344	0.79	CYP3A4 (0.64)	CYP3A4CYP2C9ADORA3DNPH1NT5E
SCHEMBL26029346	0.79	CYP3A4 (0.64)	CYP3A4CYP2C9ADORA3DNPH1NT5E

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