SCHEMBL8580671

SCHEMBL8580671

C#Cc1cc(CCCC)c(S(C)(=O)=O)cc1C(=O)N=C(N)N

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.48

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
SCHEMBL8532329 0.97 SLC9A1 (0.47) SLC9A1
SCHEMBL8533793 0.96 SLC9A1 (0.46) SLC9A1
SCHEMBL8582515 0.85 SLC9A1 (0.47) SLC9A1
SCHEMBL6934426 0.84 SLC9A1 (0.53) SLC9A1
SCHEMBL8578808 0.84 SLC9A1 (0.46) SLC9A1
SCHEMBL8532898 0.83 SLC9A1 (0.52) SLC9A1
SCHEMBL8529013 0.83 SLC9A1 (0.67) SLC9A1
SCHEMBL8531943 0.82 SLC9A1 (0.51) SLC9A1
SCHEMBL8530007 0.82 SLC9A1 (0.51) SLC9A1
SCHEMBL8583944 0.82 SLC9A1 (0.51) SLC9A1

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-5840761-A Alkylbenzoylguanidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-11-24 US disclosed