SCHEMBL11095818

COC(=O)CCCCC(=O)NCCO[C@H]1O[C@H](COC(=O)c2ccccc2)[C@H](O)[C@H](O[C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)[C@H]1NC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

	gene	UniProt	supporting neighbours	confidence
▸	LMNA	P02545	3/20	0.48

▸	KMT2A	Q03164	1/20	0.48

▸	CYP3A4	P08684	1/20	0.43

▸	MAPT	P10636	1/20	0.43

▸	CYP2C9	P11712	1/20	0.43

▸	CYP2C19	P33261	1/20	0.43

▸	POLB	P06746	2/20	0.43

▸	PAX8	Q06710	1/20	0.42

▸	ALDH1A1	P00352	2/20	0.40

▸	TSHR	P16473	1/20	0.38

▸	KDM4E	B2RXH2	1/20	0.38

▸	PRKCA	P17252	1/20	0.38

▸	AKT1	P31749	1/20	0.38

▸	PTK2	Q05397	1/20	0.38

▸	CA12	O43570	10/20	0.37

▸	CA1	P00915	10/20	0.37

▸	CA2	P00918	10/20	0.37

▸	CA9	Q16790	10/20	0.37

▸	CA14	Q9ULX7	8/20	0.37

▸	MDK	P21741	1/20	0.37

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
SCHEMBL11099143	0.86	MCHR1 (0.48)	LMNAKMT2A
SCHEMBL16360859	0.80	LMNA (0.50)	LMNAKMT2ACYP3A4MAPTCYP2C9
SCHEMBL15592304	0.80	LMNA (0.51)	LMNAKMT2ACYP3A4MAPTCYP2C9
SCHEMBL11432645	0.79	LMNA (0.49)	LMNAKMT2ACYP3A4MAPTCYP2C9
SCHEMBL22688576	0.79	CYP3A4 (0.50)	LMNAKMT2ACYP3A4MAPTCYP2C9
SCHEMBL8399805	0.78	ANTXR2 (0.39)	KMT2ACYP2C9POLBPAX8CA1
SCHEMBL8399808	0.78	ANTXR2 (0.39)	KMT2ACYP2C9POLBPAX8CA1
SCHEMBL11424374	0.78	CYP2C19 (0.47)	LMNAKMT2ACYP3A4MAPTCYP2C9
SCHEMBL10905232	0.77	LMNA (0.52)	LMNAKMT2ACYP3A4MAPTCYP2C9
SCHEMBL17230155	0.76	LMNA (0.52)	LMNAKMT2ACYP3A4MAPTCYP2C9

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-4442284-A	Chemical compounds, aminoacid attached to glycoside	BEHRINGWERKE AKTIENGESELLSCHAFT (DE)	1984-04-10	—	—	US	disclosed