SCHEMBL30008177

C[C@H](Nc1cc(Cl)nc2c1cnn2[C@@H]1O[C@H](COCP(=O)(O)ONC(=O)OC(C)(C)C)[C@H]2OC(C)(C)O[C@H]21)c1ccccc1F

nearest known ligand 0.57

Predicted protein targets (top 1)

	gene	UniProt	supporting neighbours	confidence
▸	NT5E	P21589	20/20	0.57

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
SCHEMBL24672777	1.00	NT5E (0.57)	NT5E
SCHEMBL27206798	0.89	NT5E (0.65)	NT5E
SCHEMBL30007724	0.89	NT5E (0.65)	NT5E
SCHEMBL24672775	0.89	NT5E (0.65)	NT5E
SCHEMBL24672776	0.87	NT5E (0.60)	NT5E
SCHEMBL30007766	0.85	NT5E (0.59)	NT5E
SCHEMBL30858385	0.85	NT5E (0.59)	NT5E
SCHEMBL27195208	0.85	NT5E (0.62)	NT5E
SCHEMBL30008079	0.81	NT5E (0.59)	NT5E
SCHEMBL22104979	0.81	NT5E (0.59)	NT5E

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-2022237747-A1	SMALL MOLECULAR CD73 ANTAGONIST AND USE THEREOF	四川海思科制药有限公司	2022-11-17	—	—	WO	disclosed