SCHEMBL7753897

COc1ccc(C(OC[C@H]2O[C@@H](n3ccc(NC(=O)OCCc4ccc([N+](=O)[O-])cc4)nc3=O)[C@H](OC(C)OCCc3ccc([N+](=O)[O-])cc3)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	P2RY6	Q15077	11/20	0.40

▸	P2RY2	P41231	10/20	0.40

▸	P2RY4	P51582	9/20	0.40

▸	TYMP	P19971	6/20	0.39

▸	P2RY14	Q15391	2/20	0.36

▸	NT5E	P21589	1/20	0.36

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
SCHEMBL9230969	0.94	P2RY6 (0.41)	P2RY6P2RY2P2RY4TYMPP2RY14
SCHEMBL9231628	0.86	TYMP (0.43)	TYMPNT5E
SCHEMBL9232489	0.85	P2RY2 (0.44)	P2RY6P2RY2P2RY4
SCHEMBL9232487	0.85	P2RY2 (0.44)	P2RY6P2RY2P2RY4
SCHEMBL7756536	0.84	TYMP (0.46)	TYMP
SCHEMBL7753939	0.84	P2RY2 (0.43)	P2RY6P2RY2P2RY4TYMPP2RY14
SCHEMBL10499351	0.83	TYMP (0.39)	P2RY6P2RY2P2RY4TYMPNT5E
SCHEMBL8712130	0.79	POLB (0.42)	P2RY6P2RY2P2RY4TYMP
SCHEMBL9231847	0.78	P2RY2 (0.45)	P2RY6P2RY2P2RY4
SCHEMBL9231845	0.78	P2RY2 (0.45)	P2RY6P2RY2P2RY4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-0661291-B1	Solid phase synthesis of oligoribonucleotide	AVENTIS PHARMA GMBH (DE)	2001-03-07	—	—	EP	disclosed
EP-0661291-A1	Solid phase synthesis of oligoribonucleotide	HOECHST AKTIENGESELLSCHAFT (DE)	1995-07-05	—	—	EP	disclosed