SCHEMBL19987194

COc1ncnc2c1ncn2[C@@H]1OC2(C)[C@H](COP(=O)(N[C@@H](C)C(=O)OC(C)C)Oc3ccccc3)C2(COP(=O)(N[C@@H](C)C(=O)OC(C)C)Oc2ccccc2)C1F

nearest known ligand 0.43

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	CYP3A4	P08684	2/20	0.43

▸	CYP2C9	P11712	2/20	0.43

▸	BTN3A1	O00481	4/20	0.38

▸	FLT4	P35916	1/20	0.32

▸	KDR	P35968	1/20	0.32

▸	DNPH1	O43598	2/20	0.32

▸	P2RY12	Q9H244	1/20	0.31

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
SCHEMBL19987299	0.95	CYP3A4 (0.43)	CYP3A4CYP2C9BTN3A1FLT4KDR
SCHEMBL19987282	0.93	CYP3A4 (0.41)	CYP3A4CYP2C9BTN3A1FLT4KDR
SCHEMBL19987378	0.89	DNPH1 (0.44)	CYP3A4CYP2C9DNPH1
SCHEMBL19987308	0.87	CYP3A4 (0.45)	CYP3A4CYP2C9BTN3A1DNPH1P2RY12
SCHEMBL21511201	0.87	CYP3A4 (0.45)	CYP3A4CYP2C9BTN3A1DNPH1P2RY12
SCHEMBL19987205	0.86	CYP3A4 (0.41)	CYP3A4CYP2C9BTN3A1
SCHEMBL19987284	0.86	CYP3A4 (0.39)	CYP3A4CYP2C9BTN3A1
SCHEMBL19987201	0.85	CYP3A4 (0.42)	CYP3A4CYP2C9BTN3A1P2RY12
SCHEMBL19987193	0.85	CYP3A4 (0.42)	CYP3A4CYP2C9
SCHEMBL19987269	0.84	CYP3A4 (0.41)	CYP3A4CYP2C9BTN3A1P2RY12

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