SCHEMBL6949588

CC(=O)SC1CN(c2nc(C(=O)NC(CO[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)CO[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)cs2)C1

nearest known ligand 0.33

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	PIN1	Q13526	5/20	0.33

▸	OGA	O60502	1/20	0.33

▸	ALPL	P05186	1/20	0.33

▸	ALPI	P09923	1/20	0.33

▸	ALPG	P10696	1/20	0.33

▸	HPGDS	O60760	1/20	0.32

▸	SMYD2	Q9NRG4	2/20	0.31

▸	ALK	Q9UM73	1/20	0.31

▸	ACACB	O00763	1/20	0.31

▸	ACKR3	P25106	1/20	0.31

▸	CYP3A4	P08684	1/20	0.31

▸	HTT	P42858	1/20	0.31

▸	SMN1; SMN2	Q16637	1/20	0.31

▸	L3MBTL1	Q9Y468	1/20	0.30

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
SCHEMBL5724409	0.96	OGA (0.33)	PIN1OGAALPLALPIALPG
SCHEMBL6945286	0.96	CNR1 (0.33)	PIN1OGAALPLALPIALPG
SCHEMBL6945220	0.94	CTSK (0.34)	PIN1OGAALPLALPIALPG
SCHEMBL6945217	0.94	CTSK (0.34)	PIN1OGAALPLALPIALPG
SCHEMBL7075647	0.91	OGA (0.33)	PIN1OGAALPLALPIALPG
SCHEMBL7075651	0.91	OGA (0.33)	PIN1OGAALPLALPIALPG
SCHEMBL6944143	0.89	OGA (0.32)	PIN1OGAALPLALPIALPG
SCHEMBL5724225	0.86	OGA (0.35)	OGAALPLALPIALPGACACB
SCHEMBL6944708	0.86	ACKR3 (0.37)	ALPLALPIALPGHPGDSSMYD2
SCHEMBL5723646	0.83	CNR1 (0.34)	PIN1OGAALPLALPIALPG

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-1340757-A1	1-METHYLCARBAPENEM DERIVATIVES	Sankyo Company, Limited (JP)	2003-09-03	—	—	EP	disclosed