SCHEMBL23641673

O=P(O)(S)OC[C@H]1O[C@@H](n2cnc3c(NCCN[C@@H](O)CO)ncnc32)[C@H](OP(=O)(S)OC[C@@H]2CC[C@H](n3cc4c5c(ncnc53)NCCC4)O2)[C@@H]1O

nearest known ligand 0.38

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	P2RX3	P56373	2/20	0.38

▸	P2RX2	Q9UBL9	2/20	0.38

▸	TAS1R3	Q7RTX0	1/20	0.38

▸	TAS1R1	Q7RTX1	1/20	0.38

▸	ADORA1	P30542	2/20	0.36

▸	DNPH1	O43598	1/20	0.36

▸	GPR17	Q13304	1/20	0.36

▸	RNASEL	Q05823	2/20	0.35

▸	NT5E	P21589	1/20	0.35

▸	P2RY1	P47900	1/20	0.35

▸	FHIT	P49789	1/20	0.34

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
SCHEMBL23641743	0.92	TAS1R3 (0.40)	P2RX3P2RX2TAS1R3TAS1R1ADORA1
SCHEMBL23641845	0.85	P2RX3 (0.44)	P2RX3RNASEL
SCHEMBL23641838	0.83	RNASEL (0.41)	ADORA1RNASEL
SCHEMBL23641810	0.82	RNASEL (0.41)	RNASEL
SCHEMBL24191549	0.79	RNASEL (0.34)	RNASEL
SCHEMBL23641783	0.78	P2RY1 (0.33)	TAS1R3TAS1R1NT5EP2RY1
SCHEMBL23641857	0.78	RNASEL (0.39)	RNASELNT5E
SCHEMBL23641858	0.77	AURKA (0.31)	TAS1R3TAS1R1NT5E
SCHEMBL24191193	0.77	RNASEL (0.52)	RNASEL
SCHEMBL23641683	0.76	—	—

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-3848054-A1	NOVEL CYCLIC DINUCLEOTIDE DERIVATIVE AND ANTIBODY-DRUG CONJUGATE THEREOF	Daiichi Sankyo Company, Limited (JP)	2021-07-14	—	—	EP	disclosed