SCHEMBL10067602

SCHEMBL10067602

N=C(N)NCCC[C@H](NC(=O)c1sccc1NS(=O)(=O)c1cccc(C#Cc2cccnc2)c1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NRP1 O14786 20/20 0.55
NPR1 P16066 1/20 0.45

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL11934636 0.92 NRP1 (0.60) NRP1NPR1
SCHEMBL10082610 0.90 NRP1 (0.54) NRP1NPR1
SCHEMBL4569841 0.88 NRP1 (0.52) NRP1NPR1
SCHEMBL4569823 0.88 NRP1 (0.58) NRP1NPR1
SCHEMBL2107757 0.88 NRP1 (0.56) NRP1NPR1
SCHEMBL13552604 0.87 NRP1 (0.40) NRP1NPR1
SCHEMBL4569898 0.85 NRP1 (0.59) NRP1NPR1
SCHEMBL4569856 0.85 NRP1 (0.52) NRP1NPR1
SCHEMBL3711157 0.85 NRP1 (0.74) NRP1NPR1
SCHEMBL4569839 0.84 NRP1 (0.58) NRP1NPR1

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158789-B2 Arginine derivatives with NP-I antagonistic activity Ark Therapeutics Group Ltd. (GB) 2012-04-17 US disclosed