SCHEMBL8633035

SCHEMBL8633035

Cc1cc(Nc2nccn2C)c(S(C)(=O)=O)cc1C(=O)Cl

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.33
SLC9A1 P19634 2/20 0.33
SLC9A3 P48764 1/20 0.32
SLC9A2 Q9UBY0 1/20 0.32
HTT P42858 1/20 0.31

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
SCHEMBL8630803 0.86 HTT (0.32) FDPSHTT
SCHEMBL8635031 0.84 SLC9A1 (0.56) SLC9A1SLC9A3SLC9A2
SCHEMBL8634301 0.79 SLC9A1 (0.36) SLC9A1
SCHEMBL8632612 0.76 SMN1; SMN2 (0.39)
SCHEMBL8636380 0.76 HTT (0.33) SLC9A1SLC9A3SLC9A2HTT
SCHEMBL8635344 0.76 KMT2A (0.36) SLC9A1
SCHEMBL8634805 0.75 TYK2 (0.48) HTT
SCHEMBL8635924 0.73 SLC9A1 (0.43) SLC9A1
SCHEMBL8635463 0.73 AKR1C3 (0.45)
SCHEMBL8635848 0.72 CYP11B2 (0.46)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1057999-C 4-Aminobenzoylguanidine derivatives MERCK PATENT GMBH (DE) 2000-11-01 CN disclosed
US-5739142-A 4-aminobenzoylguanidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-04-14 US disclosed
CN-1138575-A 4-aminobenzoylguanidine derivatives MERCK PATENT GMBH (DE) 1996-12-25 CN disclosed