SCHEMBL8631380

SCHEMBL8631380

CCc1cc(N(C)c2nccn2C)c(S(C)(=O)=O)cc1C(=O)Cl

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL8636380 0.87 HTT (0.33) HTTSMN1; SMN2
SCHEMBL8631754 0.85 SLC9A1 (0.42)
SCHEMBL8631189 0.82 MEN1 (0.31)
SCHEMBL8635757 0.77 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL8630803 0.77 HTT (0.32) HTT
SCHEMBL8637032 0.77 ALDH1A1 (0.36)
SCHEMBL8635336 0.77 FFAR2 (0.33)
SCHEMBL27351468 0.76 HRH4 (0.37)
SCHEMBL8635203 0.75 HSP90AA1 (0.35) SMN1; SMN2
SCHEMBL8634309 0.74 SLC9A1 (0.31)

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