SCHEMBL13045392

C=C1N[C@H]2CSC(CCCCC(=O)NCCCC[C@H](NC(=O)CN(CCOC)C(=O)CN(CCOC)C(=O)CN(CCCCN)C(=O)CN(CCOC)C(C)=O)C(N)=O)[C@H]2N1

nearest known ligand 0.43

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	FOLH1	Q04609	6/20	0.43

▸	PRSS1	P07477	3/20	0.41

▸	PRSS2	P07478	3/20	0.41

▸	PRSS3	P35030	3/20	0.41

▸	TPSAB1	Q15661	3/20	0.41

▸	PLG	P00747	2/20	0.41

▸	TDP1	Q9NUW8	1/20	0.41

▸	F2	P00734	2/20	0.38

▸	PLCD1	P51178	1/20	0.37

▸	VIM	P08670	1/20	0.37

▸	CAPN1	P07384	2/20	0.36

▸	CNR1	P21554	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
SCHEMBL10085160	0.95	TDP1 (0.44)	FOLH1PRSS1PRSS2PRSS3TPSAB1
SCHEMBL10085179	0.94	PRSS1 (0.42)	FOLH1PRSS1PRSS2PRSS3TPSAB1
SCHEMBL10085177	0.94	PRSS1 (0.41)	FOLH1PRSS1PRSS2PRSS3TPSAB1
SCHEMBL16350682	0.93	FOLH1 (0.51)	FOLH1PRSS1PRSS2PRSS3TPSAB1
SCHEMBL10085165	0.91	PRSS1 (0.40)	FOLH1PRSS1PRSS2PRSS3TPSAB1
SCHEMBL13045391	0.90	PLG (0.42)	FOLH1PRSS1PRSS2PRSS3TPSAB1
SCHEMBL14524594	0.90	TDP1 (0.43)	FOLH1PRSS1PRSS2PRSS3TPSAB1
SCHEMBL13045377	0.89	PLG (0.42)	FOLH1PRSS1PRSS2PRSS3TPSAB1
SCHEMBL14601079	0.88	TDP1 (0.54)	FOLH1PRSS1PRSS2PRSS3TPSAB1
SCHEMBL13045421	0.88	TDP1 (0.54)	FOLH1PRSS1PRSS2PRSS3TPSAB1

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-7834144-B2	Prion-specific peptoid reagents	NOVARTIS AG (CH)	2010-11-16	—	—	US	disclosed