SCHEMBL8399808

COC(=O)CCCCCCCCO[C@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O[C@@H]2O[C@H](COC(=O)c3ccccc3)[C@H](O)[C@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

	gene	UniProt	supporting neighbours	confidence
▸	ANTXR2	P58335	1/20	0.39

▸	USP2	O75604	2/20	0.39

▸	MEN1	O00255	1/20	0.39

▸	POLB	P06746	1/20	0.39

▸	KMT2A	Q03164	1/20	0.39

▸	PTPN1	P18031	9/20	0.38

▸	TNF	P01375	2/20	0.38

▸	PAX8	Q06710	1/20	0.38

▸	XDH	P47989	1/20	0.37

▸	LGALS3	P17931	2/20	0.37

▸	LGALS9	O00182	1/20	0.37

▸	LGALS1	P09382	1/20	0.37

▸	LGALS7; LGALS7B	P47929	1/20	0.37

▸	LGALS4	P56470	1/20	0.36

▸	PTPN2	P17706	1/20	0.36

▸	PTPN6	P29350	1/20	0.36

▸	PTPN11	Q06124	1/20	0.36

▸	TMPRSS2	O15393	1/20	0.35

▸	PDE5A	O76074	1/20	0.35

▸	CA1	P00915	1/20	0.35

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
SCHEMBL8399805	1.00	ANTXR2 (0.39)	ANTXR2USP2MEN1POLBKMT2A
SCHEMBL8397803	0.89	HPSE (0.47)	—
SCHEMBL8398082	0.89	F11 (0.37)	ANTXR2USP2MEN1POLBKMT2A
SCHEMBL26445770	0.87	PTPN1 (0.47)	ANTXR2USP2MEN1POLBKMT2A
SCHEMBL26445758	0.87	PTPN1 (0.47)	ANTXR2USP2MEN1POLBKMT2A
SCHEMBL8906435	0.86	LGALS3 (0.51)	PTPN1LGALS3LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL10177707	0.86	ANTXR2 (0.46)	ANTXR2USP2MEN1POLBKMT2A
SCHEMBL8906431	0.86	LGALS3 (0.51)	PTPN1LGALS3LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL22455859	0.85	LGALS3 (0.43)	USP2MEN1POLBKMT2APTPN1
SCHEMBL15833428	0.84	PAX8 (0.41)	ANTXR2USP2MEN1POLBKMT2A

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
US-5874411-A	ANTIINFLAMMATORY	GLYCOMED INCORPORATED (US)	1999-02-23	—	—	US	disclosed