SCHEMBL13678657

N[C@@H]1C(CCCCC(=O)NCCCCCNC(=O)CCSC(C(=O)NCCOCCOCCNC(=O)c2ccc(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c(C(=O)O)c2)c2ccccc2)SC[C@@H]1NC=O

nearest known ligand 0.46

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	FOLH1	Q04609	2/20	0.46

▸	SLC5A2	P31639	2/20	0.45

▸	ALB	P02768	2/20	0.44

▸	HTRA2	O43464	8/20	0.42

▸	HTRA1	Q92743	8/20	0.42

▸	AVPR2	P30518	1/20	0.42

▸	OXTR	P30559	1/20	0.42

▸	AVPR1A	P37288	1/20	0.42

▸	ESR1	P03372	1/20	0.40

▸	HTR3A	P46098	1/20	0.40

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
SCHEMBL13780484	0.96	FOLH1 (0.47)	FOLH1SLC5A2ALBHTRA2HTRA1
SCHEMBL9906218	0.94	FOLH1 (0.47)	FOLH1SLC5A2ALBHTRA2HTRA1
SCHEMBL9906263	0.88	FOLH1 (0.46)	FOLH1SLC5A2ALBHTRA2HTRA1
SCHEMBL13678652	0.87	CA9 (0.43)	FOLH1SLC5A2ALBHTR3A
SCHEMBL14619873	0.84	FOLH1 (0.43)	FOLH1SLC5A2ALBHTRA2HTRA1
SCHEMBL9906264	0.84	ALB (0.48)	FOLH1SLC5A2ALBHTRA2HTRA1
SCHEMBL14140516	0.84	HTRA2 (0.38)	FOLH1SLC5A2ALBHTRA2HTRA1
SCHEMBL13678641	0.82	ALB (0.48)	FOLH1SLC5A2ALBHTRA2HTRA1
SCHEMBL18699631	0.80	ALB (0.56)	FOLH1SLC5A2ALBHTRA2HTRA1
SCHEMBL14402764	0.78	FOLH1 (0.50)	FOLH1SLC5A2ALBHTRA2HTRA1

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-1540347-B1	DETECTING RECEPTOR OLIGOMERIZATION	ACLARA BIOSCIENCES INC (US)	2009-09-09	—	—	EP	disclosed