SCHEMBL18697704

CCOC(=O)[C@H](Cc1c[nH]c2ccccc12)NP(=O)(OC[C@H]1O[C@@](C)(c2ccc3c(N)ncnn23)[C@@H](C)[C@@H]1O)Oc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	MAPT	P10636	4/20	0.40

▸	TP53	P04637	3/20	0.40

▸	LMNA	P02545	1/20	0.40

▸	THRB	P10828	1/20	0.40

▸	P2RY14	Q15391	1/20	0.35

▸	POLB	P06746	1/20	0.35

▸	ACE	P12821	2/20	0.34

▸	MME	P08473	1/20	0.34

▸	ECE1	P42892	1/20	0.34

▸	LNPEP	Q9UIQ6	1/20	0.33

▸	P2RY12	Q9H244	1/20	0.33

▸	MMP2	P08253	1/20	0.33

▸	MMP3	P08254	1/20	0.33

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
SCHEMBL881585	0.91	MAPT (0.39)	MAPTTP53LMNATHRBP2RY14
SCHEMBL20882193	0.89	HPRT1 (0.37)	—
SCHEMBL10149577	0.86	MAPT (0.38)	MAPTTP53LMNATHRBP2RY14
SCHEMBL18697843	0.85	CYP3A4 (0.33)	—
SCHEMBL18697730	0.85	CYP3A4 (0.33)	—
SCHEMBL20882149	0.85	MAPT (0.39)	MAPTTP53LMNATHRBP2RY14
SCHEMBL19223219	0.84	HPRT1 (0.38)	—
SCHEMBL20078641	0.81	RIPK1 (0.33)	—
SCHEMBL20882287	0.81	BTN3A1 (0.33)	—
SCHEMBL10148613	0.81	MAPT (0.38)	MAPTTP53LMNATHRBP2RY14

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-3150608-A1	2' -FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT	Gilead Sciences, Inc. (US)	2017-04-05	—	—	EP	disclosed