SCHEMBL16482911

CC[C@H](C)[C@H](NC(=O)[C@H](CCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N(C)[C@@H](Cc1ccc(OC(C)(C)C)cc1)C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	PTPN1	P18031	8/20	0.43

▸	GRB2	P62993	1/20	0.39

▸	TLR2	O60603	2/20	0.38

▸	MDM2	Q00987	3/20	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
SCHEMBL16482913	0.85	PTPN1 (0.42)	PTPN1
SCHEMBL29670135	0.74	CASP3 (0.44)	PTPN1MDM2
SCHEMBL13517728	0.74	MDM2 (0.53)	TLR2MDM2
SCHEMBL13517725	0.74	MDM2 (0.53)	TLR2MDM2
SCHEMBL30069010	0.73	PTPN1 (0.49)	PTPN1GRB2MDM2
SCHEMBL27172564	0.73	PTPN1 (0.49)	PTPN1GRB2MDM2
SCHEMBL27204705	0.73	PTPN1 (0.49)	PTPN1GRB2MDM2
SCHEMBL7391232	0.72	PTPN1 (0.46)	PTPN1
SCHEMBL7391230	0.72	PTPN1 (0.46)	PTPN1
SCHEMBL13561434	0.72	HDAC1 (0.53)	TLR2MDM2

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
WO-2014057418-A2	SOLUTION PHASE PROCESSES FOR THE MANUFACTURE OF MACROCYCLIC DEPSIPEPTIDES AND NEW INTERMEDIATES	NOVARTIS AG (CH)	2014-04-17	—	—	WO	disclosed